PubChem_CID,Name,SMILES,InChIKey,Synonym,DTXSID,Class_parent
13101,6PPD,CC(C)CC(C)NC1=CC=C(C=C1)NC2=CC=CC=C2,ZZMVLMVFYMGSMY-UHFFFAOYSA-N,"N-(1,3-dimethylbutyl)-N'-phenyl-p-phenylenediamine",DTXSID9025114,Tire wear
154926030,6PPD-quinone,CC(C)CC(C)NC1=CC(=O)C(NC2=CC=CC=C2)=CC1(=O),UBMGKRIXKUIXFQ-UHFFFAOYSA-N,,,
67215,Leucomalachite green,CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C,WZKXBGJNNCGHIC-UHFFFAOYSA-N,,DTXSID7031531,Dye
11294,Malachite green,CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3.[Cl-],FDZZZRQASAIRJF-UHFFFAOYSA-M,,DTXSID1025512,Dye
11295,Malachite green cation,CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=CC=C3,VFCNQNZNPKRXIT-UHFFFAOYSA-N,,DTXSID3043784,Dye
71091427,4-[[4-(Dimethylamino) phenyl]-phenylmethyl]-N-methylaniline,CNC1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)N(C)C,MCEWFWVFARJELO-UHFFFAOYSA-N,,,
12421730,"4,4'-(Phenylmethylene)bis(N-methylaniline)",CNC1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)NC,OPQNVMBGRKGHPG-UHFFFAOYSA-N,,,
19064224,4-(Methylamino)benzophenone,CNC1=CC=C(C=C1)C(=O)C2=CC=CC=C2,REYZVMWSJNEXKO-UHFFFAOYSA-N,,DTXSID00597743,
74483,PFOS,C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F,YFSUTJLHUFNCNZ-UHFFFAOYSA-N,,DTXSID3031864,PFAS
14571268,Perfluorooctanol,C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(O)(F)F)(F)F)(F)F)(F)F,UQDUPHDELLQMOV-UHFFFAOYSA-N,,DTXSID90561796,PFAS
67634,Perfluorooctanoyl fluoride,C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F,ZILWJLIFAGWGLE-UHFFFAOYSA-N,,DTXSID0059829,PFAS
9554,PFOA,C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O,SNGREZUHAYWORS-UHFFFAOYSA-N,,DTXSID8031865,PFAS
22160290,Perfluoroheptanol,C(C(C(C(O)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F,XCWMATKNFUWXCN-UHFFFAOYSA-N,,DTXSID70623043,PFAS
67817,Perfluoroheptanoyl fluoride,C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F,XLIFBQWTSCGUEB-UHFFFAOYSA-N,,DTXSID4059918,PFAS
67542,PFHxA,C(=O)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)O,PXUULQAPEKKVAH-UHFFFAOYSA-N,,DTXSID3031862,PFAS
75921,PFPeA,C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)O,CXZGQIAOTKWCDB-UHFFFAOYSA-N,,DTXSID6062599,PFAS
9777,PFBA,C(=O)(C(C(C(F)(F)F)(F)F)(F)F)O,YPJUNDFVDDCYIH-UHFFFAOYSA-N,,DTXSID4059916,PFAS
62356,PFPA,C(=O)(C(C(F)(F)F)(F)F)O,LRMSQVBRUNSOJL-UHFFFAOYSA-N,,DTXSID8059970,PFAS
67734,PFHxS,C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F,QZHDEAJFRJCDMF-UHFFFAOYSA-N,,DTXSID7040150,PFAS
67815,PFBS,C(C(C(F)(F)S(=O)(=O)O)(F)F)(C(F)(F)F)(F)F,JGTNAGYHADQMCM-UHFFFAOYSA-N,,DTXSID5030030,PFAS
67818,PFHpA,C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O,ZWBAMYVPMDSJGQ-UHFFFAOYSA-N,,DTXSID1037303,PFAS
280,Carbon dioxide,C(=O)=O,CURLTUGMZLYLDI-UHFFFAOYSA-N,,DTXSID4027028,
962,Water,O,XLYOFNOQVPJJNP-UHFFFAOYSA-N,,DTXSID6026296,
28179,Fluoride,[F-],KRHYYFGTRYWZRS-UHFFFAOYSA-M,,DTXSID9049617,
1117,Sulphate,[O-]S(=O)(=O)[O-],QAOWNCQODCNURD-UHFFFAOYSA-L,,DTXSID3042425,
23234364,Perfluorocyclooctane,C1(C(C(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,BCLLRNVMLZXSMM-UHFFFAOYSA-N,,,
10132570,Perfluorocycloheptane,C1(C(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,FNVLGCVAWPSVSK-UHFFFAOYSA-N,,DTXSID10436078,
9640,Perfluorocyclohexane,C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,RKIMETXDACNTIE-UHFFFAOYSA-N,,DTXSID5075232,
67828,Perfluorocyclopentane,C1(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F,PWMJXZJISGDARB-UHFFFAOYSA-N,,DTXSID10191039,
8263,Perfluorocyclobutane,C1(C(C(C1(F)F)(F)F)(F)F)(F)F,BCCOBQSFUDVTJQ-UHFFFAOYSA-N,,DTXSID9041811,
62479,Hexa(methoxymethyl)melamine,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)COC,BNCADMBVWNPPIZ-UHFFFAOYSA-N,hexamethoxymethylmelamine (HMMM),DTXSID9027520,
18785363,Penta(methoxymethyl)melamine,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC),LEVZZYOVVQKGOM-UHFFFAOYSA-N,PMMM ,DTXSID30596249,
83757,HMMM TP377,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)CO,JQALNNOQTGZTJZ-UHFFFAOYSA-N,HMMM TP377,DTXSID90930024,
156601178,HMMM TP375,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(COC)C=O,UPFQVJAGBXCQOE-UHFFFAOYSA-N,HMMM TP375,,
19596821,Tetra(methoxymethyl)melamine,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N,GDXYMSLKTXSGBS-UHFFFAOYSA-N,TetraMMM ,DTXSID30598925,
20318181,HMMM TP363,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(CO)CO,GSRBPSZSSSOAHJ-UHFFFAOYSA-N,HMMM TP363,,
156601175,HMMM TP383,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(C=O)CO,PRDOSDUGXKTFET-UHFFFAOYSA-N,HMMM TP383,,
156601177,HMMM TP353,COCN(COC)C1=NC(=NC(=N1)N(COC)COC)N(C=O),TXFCZCYWLIIXLR-UHFFFAOYSA-N,HMMM TP353,,
20067384,Tri(methoxymethyl)melamine,COCN(COC)C1=NC(=NC(=N1)N(COC))N,QRUPLLGJMSYASL-UHFFFAOYSA-N,TriMMM ,,
20463987,HMMM TP311,COCN(COC)C1=NC(=NC(=N1)N(COC)CO)N,QMMGPJGNVGPLON-UHFFFAOYSA-N,HMMM TP311,,
156601179,HMMM TP287,COCN(COC)C1=NC(=NC(=N1)N(COC)C=O)N,VASSCAPEVQZJKA-UHFFFAOYSA-N,HMMM TP287,,
20484942,HMMM TP349,COCN(COC)C1=NC(=NC(=N1)N(COC)CO)N(CO)CO,JFPDYZRUBOUZEV-UHFFFAOYSA-N,HMMM TP349,,
156601173,HMMM TP339,COCN(COC)C1=NC(=NC(=N1)N(C=O)CO)N(COC),DSPHGRWZRGBFBS-UHFFFAOYSA-N,HMMM TP339,,
156601180,HMMM TP315,COCN(COC)C1=NC(=NC(=N1)N(C=O)C=O)N(COC),ZEDNIDNOYZSSMO-UHFFFAOYSA-N,HMMM TP315,,
19596820,Bis(methoxymethyl)melamine,COCN(COC)C1=NC(=NC(=N1)N)N,ZZQSSGSSJLWADI-UHFFFAOYSA-N,DiMMM ,,
53965793,HMMM TP245,COCN(COC)C1=NC(=NC(=N1)N(CO))N,JOCMJNZFQXOCOZ-UHFFFAOYSA-N,HMMM TP245,,
156601176,HMMM TP243,COCN(COC)C1=NC(=NC(=N1)N(C=O))N,QJQMZQYWVWCKJV-UHFFFAOYSA-N,HMMM TP243,,
156601174,HMMM TP325,COCN(COC)C1=NC(=NC(=N1)N(CO)CO)N(C=O),FEWJLIJJJNSFNR-UHFFFAOYSA-N,HMMM TP325,,
77943,Methoxymethylmelamine,COCNC1=NC(=NC(=N1)N)N,KFVIYKFKUYBKTP-UHFFFAOYSA-N,MonoMMM ,DTXSID20962611,
7955,Melamine,NC1=NC(=NC(=N1)N)N,JDSHMPZPIAZGSV-UHFFFAOYSA-N,Melamine ,DTXSID6020802,
70300,"[(4,6-Diamino-1,3,5-triazin-2-yl)amino]methanol",OCNC1=NC(=NC(=N1)N)N,MBHRHUJRKGNOKX-UHFFFAOYSA-N,HMMM TP157,DTXSID30918200,
25796,"N-(4,6-Diamino-1,3,5-triazin-2-yl)formamide",O=CNC1=NC(=NC(=N1)N)N,BPISYIZLDVUTAP-UHFFFAOYSA-N,HMMM TP155,DTXSID20157505,
14550408,6:2 diPAP,C(COP(=O)(O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,ZDYYWMSLMLTXDM-UHFFFAOYSA-N,6:2 Fluorotelomer phosphate diester,DTXSID50561590,PFAS
156620404,6:2 FTMAP,O=P1(O)OCC(CSCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(CO1)CSCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,IPWHZYSPFHBGAW-UHFFFAOYSA-N,,,PFAS
102352,diSAmPAP,OP(=O)(OCCN(CC)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)OCCN(CC)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,BZZAKKWGRKFWJJ-UHFFFAOYSA-N,Bis(2-{ethyl[(perfluorooctyl)sulfonyl]amino}ethyl) hydrogen phosphate,DTXSID2062747,PFAS
18134,EtFOSAA,CCN(CC(=O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,CKRXVVGETMYFIO-UHFFFAOYSA-N,2-(N-Ethylperfluorooctanesulfonamido)acetic acid,DTXSID5062760,PFAS
10507011,FOSAA,C(C(=O)O)NS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,AYLOUUCBACYHAB-UHFFFAOYSA-N,"N-[(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Heptadecafluorooctyl)sulfonyl]glycine",DTXSID40440941,PFAS
69785,FOSA,C(C(C(C(C(F)(F)S(=O)(=O)N)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F,RRRXPPIDPYTNJG-UHFFFAOYSA-N,Perfluorooctanesulfonamide,DTXSID3038939,PFAS
119688,6:2 FTSA,OS(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,VIONGDJUYAYOPU-UHFFFAOYSA-N,6:2 Fluorotelomer sulfonic acid,DTXSID6067331,PFAS
3022253,8:2 diPAPS,OP(=O)(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,AFWOYEYXUDHGHF-UHFFFAOYSA-N,8:2 Fluorotelomer phosphate diester,DTXSID90218051,PFAS
10143739,8:2 monoPAPS,OP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,MIABSAQIFYEDJP-UHFFFAOYSA-N,8:2 Fluorotelomer phosphate monoester,DTXSID60874027,PFAS
69619,8:2 FTOH,OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,JJUBFBTUBACDHW-UHFFFAOYSA-N,8:2 Fluorotelomer alcohol,DTXSID7029904,PFAS
71750812,8:2 FTOH-Gluc,C(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,UZMXIMHOMUBIEV-UQGZVRACSA-N,8:2 Fluorotelomer alcohol glucuronide,DTXSID50858139,PFAS
15936172,8:2 FTOH-Sulfate,C(COS(=O)(=O)O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,UWHCRBKABHKUTC-UHFFFAOYSA-N,8:2 Fluorotelomer alcohol sulfate,DTXSID001034664,PFAS
10095866,8:2 FTAL,C(C=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,KDGIOTBLYAPNRR-UHFFFAOYSA-N,8:2 Fluorotelomer aldehyde,DTXSID10895489,PFAS
10994425,8:2 FTCA,C(C(=O)O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,XTBXSCIWOVSSGB-UHFFFAOYSA-N,8:2 Fluorotelomer carboxylic acid,DTXSID50451109,PFAS
67821,PFNA,C(=O)(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O,UZUFPBIDKMEQEQ-UHFFFAOYSA-N,Perfluorononanoic acid,DTXSID8031863,PFAS
20111612,(Z)-8:2 FTUAL,C(=C(/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)\F)\C=O,LQERGGUGOIACQD-IWQZZHSRSA-N,(Z)-8:2 Fluorotelomer unsaturated aldehyde,DTXSID10895626,PFAS
92017308,(E)-8:2 FTUAL,C(=C(\C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)/F)\C=O,LQERGGUGOIACQD-HNQUOIGGSA-N,(E)-8:2 Fluorotelomer unsaturated aldehyde,DTXSID80794091,PFAS
11733192,(Z)-8:2 FTUCA,C(=C(/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)\F)\C(=O)O,WHZXTVOEGZRRJM-UPHRSURJSA-N,(Z)-8:2 Fluorotelomer unsaturated carboxylic acid,DTXSID001019143,PFAS
11282540,(E)-8:2 FTUCA,C(=C(\C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)/F)\C(=O)O,WHZXTVOEGZRRJM-OWOJBTEDSA-N,(E)-8:2 Fluorotelomer unsaturated carboxylic acid,,PFAS
162393340,GS-(Z)-8:2 FTUAL,FC(F)(C(=C\C=O)\SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,OQCMXQJHGOIKKP-OQFOIZHKSA-N,(Z)-8:2 Fluorotelomer unsaturated aldehyde glutathione conjugate,,PFAS
162393341,GS-(Z)-8:2 FTUCA,FC(F)(C(=C/C(=O)O)/SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,ZOYZDBBMBCZXPK-BAQGIRSFSA-N,(Z)-8:2 Fluorotelomer unsaturated carboxylic acid glutathione conjugate,,PFAS
69537,6:2 FTOH,OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,GRJRKPMIRMSBNK-UHFFFAOYSA-N,6:2 Fluorotelomer alcohol,DTXSID5044572,PFAS
91350838,6:2 FTOH-Sulfate,C(COS(=O)(=O)O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,BGJBRLCWYHDOSY-UHFFFAOYSA-N,6:2 Fluorotelomer alcohol sulfate,DTXSID301023145,PFAS
162396675,6:2 FTOH-Gluc,C(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,QGCRDEVAWUFVFN-UQGZVRACSA-N,6:2 Fluorotelomer alcohol glucuronide,,PFAS
2776269,6:2 FTAL,C(C=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,WJSFZGPTEQNWCB-UHFFFAOYSA-N,6:2 Fluorotelomer aldehyde,DTXSID20895379,PFAS
11783764,6:2 FTCA,C(C(=O)O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,LRWIIEJPCFNNCZ-UHFFFAOYSA-N,6:2 Fluorotelomer carboxylic acid,DTXSID50472556,PFAS
146171053,(Z)-6:2 FTUAL,C(=C(/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)\F)\C=O,IRFCYNBOXLFPAS-IWQZZHSRSA-N,(Z)-6:2 Fluorotelomer unsaturated aldehyde,,PFAS
162396673,(E)-6:2 FTUAL,C(=C(\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)/F)\C=O,IRFCYNBOXLFPAS-HNQUOIGGSA-N,(E)-6:2 Fluorotelomer unsaturated aldehyde,,PFAS
86290106,(Z)-6:2 FTUCA,C(=C(/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)\F)\C(=O)O,BKOBFLVYTXYFQZ-UPHRSURJSA-N,(Z)-6:2 Fluorotelomer unsaturated carboxylic acid,DTXSID201036280,PFAS
129411141,(E)-6:2 FTUCA,C(=C(\C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)/F)\C(=O)O,BKOBFLVYTXYFQZ-OWOJBTEDSA-N,(E)-6:2 Fluorotelomer unsaturated carboxylic acid,DTXSID30891463,PFAS
74883,4:2 FTOH,OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F,JCMNMOBHVPONLD-UHFFFAOYSA-N,4:2 Fluorotelomer alcohol,DTXSID1062122,PFAS
162396679,4:2 FTOH-Sulfate,C(COS(=O)(=O)O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F,ZMKOLQPMWYJIKZ-UHFFFAOYSA-N,4:2 Fluorotelomer alcohol sulfate,DTXSID601034662,PFAS
162396677,4:2 FTOH-Gluc,C(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F,TYGAIOOXICPGHG-UQGZVRACSA-N,4:2 Fluorotelomer alcohol glucuronide,,PFAS
10422795,4:2 FTAL,C(C=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F,PLXBWBKXCKSJRL-UHFFFAOYSA-N,4:2 Fluorotelomer aldehyde,DTXSID80895239,PFAS
15544178,4:2 FTCA,C(C(=O)O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F,PMNVMTIBUIRJHZ-UHFFFAOYSA-N,4:2 Fluorotelomer carboxylic acid,DTXSID401033501,PFAS
162396670,(E)-4:2 FTUAL,C(=C(\C(C(C(F)(F)F)(F)F)(F)F)/F)\C=O,HFHWKEZNQKNBEL-HNQUOIGGSA-N,(E)-4:2 Fluorotelomer unsaturated aldehyde,,PFAS
146171041,(Z)-4:2 FTUAL,C(=C(/C(C(C(F)(F)F)(F)F)(F)F)\F)\C=O,HFHWKEZNQKNBEL-IWQZZHSRSA-N,(Z)-4:2 Fluorotelomer unsaturated aldehyde,,PFAS
87587204,(Z)-4:2 FTUCA,C(=C(/C(C(C(F)(F)F)(F)F)(F)F)\F)\C(=O)O,CMFAKTRZLATJOA-UPHRSURJSA-N,(Z)-4:2 Fluorotelomer unsaturated carboxylic acid,,PFAS
162396669,(E)-4:2 FTUCA,C(=C(\C(C(C(F)(F)F)(F)F)(F)F)/F)\C(=O)O,CMFAKTRZLATJOA-OWOJBTEDSA-N,(E)-4:2 Fluorotelomer unsaturated carboxylic acid,,PFAS
108644,2:2 FTOH,C(CO)C(C(F)(F)F)(F)F,JPMHUDBOKDBBLG-UHFFFAOYSA-N,2:2 Fluorotelomer alcohol,DTXSID6068985,PFAS
162396676,2:2 FTOH-Sulfate,C(COS(=O)(=O)O)C(C(F)(F)F)(F)F,QXFRKSXYXQTUIP-UHFFFAOYSA-N,2:2 Fluorotelomer alcohol sulfate,DTXSID201034660,PFAS
162396674,2:2 FTOH-Gluc,C(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)C(C(F)(F)F)(F)F,NFZAQCCKOVPTTE-UQGZVRACSA-N,2:2 Fluorotelomer alcohol glucuronide,,PFAS
10374737,2:2 FTAL,C(C=O)C(C(F)(F)F)(F)F,UNBXLINXSUCFBI-UHFFFAOYSA-N,2:2 Fluorotelomer aldehyde,DTXSID601032654,PFAS
11148047,2:2 FTCA,C(C(=O)O)C(C(F)(F)F)(F)F,UVLNQGHDUGHTGV-UHFFFAOYSA-N,2:2 Fluorotelomer carboxylic acid,DTXSID301032879,PFAS
162396672,(Z)-2:2 FTUAL,C(=C(/C(F)(F)F)\F)\C=O,HSUJHGMYGPOOSW-IWQZZHSRSA-N,(Z)-2:2 Fluorotelomer unsaturated aldehyde,,PFAS
162396671,(E)-2:2 FTUAL,C(=C(\C(F)(F)F)/F)\C=O,HSUJHGMYGPOOSW-HNQUOIGGSA-N,(E)-2:2 Fluorotelomer unsaturated aldehyde,,PFAS
23116759,(Z)-2:2 FTUCA,C(=C(/C(F)(F)F)\F)\C(=O)O,WKAYWQKZZYEPTI-UPHRSURJSA-N,(Z)-2:2 Fluorotelomer unsaturated carboxylic acid,,PFAS
162396678,(E)-2:2 FTUCA,C(=C(\C(F)(F)F)/F)\C(=O)O,WKAYWQKZZYEPTI-OWOJBTEDSA-N,(E)-2:2 Fluorotelomer unsaturated carboxylic acid,,PFAS
6422,TFA,C(=O)(C(F)(F)F)O,DTQVDTLACAAQTR-UHFFFAOYSA-N,Trifluoroacetic acid,DTXSID9041578,PFAS
12040286,"2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-(2-hydroxyethyl)octanamide",C(CO)NC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,ZATOFJIVPAZTIE-UHFFFAOYSA-N,,,PFAS
3021063,"N-(3-Aminopropyl)-2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanamide",C(CN)CNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,YIQVOMZDSOSAQY-UHFFFAOYSA-N,,DTXSID30235262,PFAS
71325636,"N-ethyl-2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanamide",CCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,XSXMZXBMPHWDLH-UHFFFAOYSA-N,,DTXSID10754941,PFAS
54479698,"3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propanoic acid",C(CNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)O,XODISSAMZUDOQA-UHFFFAOYSA-N,,,PFAS
138394414,8:2 FtSOAoS,CC(C)(CS(=O)(=O)O)NC(=O)CCS(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,XKGMPVQXAFQLEK-UHFFFAOYSA-N,,DTXSID60892605,PFAS
15333596,"3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfanyl)propanoic acid",C(CSCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)O,XAZKWGLYRRMFFE-UHFFFAOYSA-N,FtTP,DTXSID40571648,PFAS
139597752,4:2 FtSOAoS,CC(C)(CS(=O)(=O)O)NC(=O)CCS(=O)CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F,WVSBUXQVQMSEID-UHFFFAOYSA-N,,,PFAS
71404795,8:2 FtUCA,C(=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F)C(=O)O,WHZXTVOEGZRRJM-UHFFFAOYSA-N,,DTXSID60825615,PFAS
15579285,PFOAAmS,C[N+](C)(C)CCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,VJAUUPGCVZMKLX-UHFFFAOYSA-O,,DTXSID10892574,PFAS
138394388,4:2 FtTAoS ion,CC(C)(CS(=O)(=O)[O-])NC(=O)CCSCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F,VIHJAWYQCFERKN-UHFFFAOYSA-M,,DTXSID40892527,PFAS
67919,Perfluorooctanamide,C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N,UGMUDSKJLAUMTC-UHFFFAOYSA-N,,DTXSID60195123,PFAS
20734543,4:2 FtS ,C(CS(=O)(=O)O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F,TXGIGTRUEITPSC-UHFFFAOYSA-N,,DTXSID30891564,PFAS
15579283,PFOAAm,CN(C)CCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,STMOMAISLIDGHH-UHFFFAOYSA-N,,DTXSID90892572,PFAS
163201607,dehydroxy-demethylene-TFHFESE,[CH2]SC(C(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F,SQCDMAHMWJWARM-UHFFFAOYSA-N,,,PFAS
138394570,"2-methyl-2-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonyl)propanoylamino]propane-1-sulfonic acid",CC(C)(CS(=O)(=O)O)NC(=O)CCS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,RZBHYDQKJKDSNP-UHFFFAOYSA-N,FtSO2AoS,DTXSID90894132,PFAS
163198788,"(Z)-1,2-difluoro-2-(hydroxymethylsulfanyl)ethenol",F/C(=C(/F)\SCO)/O,QNWCDOKEOSCYJA-NSCUHMNNSA-N,,,
163201608,dehydroxy-TFHFESE,[CH2]CSC(C(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F,PUJWVXUDMXVDKW-UHFFFAOYSA-N,,,PFAS
88708330,"1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-[3-(methylamino)propyl]octane-1-sulfonamide",CNCCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,OKSQBKOGKKWDQV-UHFFFAOYSA-N,,,PFAS
2759276,pentafluoroethanol,C(C(F)(F)F)(O)(F)F,NNZZMYIWZFZLHU-UHFFFAOYSA-N,,,PFAS
83421,"N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide",CN(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,MSJXTBMNRCTIDR-UHFFFAOYSA-N,,DTXSID9065443,PFAS
139596029,4:2 FtSO2AoS,CC(C)(CS(=O)(=O)O)NC(=O)CCS(=O)(=O)CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F,MDGZRVCSTWUTMU-UHFFFAOYSA-N,,DTXSID101035908,PFAS
121432785,TFHFESE,C(CSC(C(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)O,LHDNIAQMOXWLLQ-UHFFFAOYSA-N,,,PFAS
54022570,"2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanoylamino)acetic acid",C(C(=O)O)NC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,KZYDHGQYENTJQK-UHFFFAOYSA-N,,,PFAS
15936166,8:2 FtTAoS,CC(C)(CS(=O)(=O)O)NC(=O)CCSCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,JPUVFTMCVQSFAF-UHFFFAOYSA-N,,DTXSID30892334,PFAS
20436299,"N-(3-aminopropyl)-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide",C(CN)CNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,IOOWGYMOCNYMST-UHFFFAOYSA-N,,,PFAS
2783376,7:3 FtCA,C(CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)O,HLBRGVKRZQSQHB-UHFFFAOYSA-N,,DTXSID90382620,PFAS
84097,"3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonylamino)propyl-trimethylazanium",C[N+](C)(C)CCCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,FGTDPZOJJFPWCB-UHFFFAOYSA-N,,DTXSID10859667,PFAS
101895126,"1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(2-oxoethyl)octane-1-sulfonamide",C(C=O)NS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,DTKWOQZHQQMDSO-UHFFFAOYSA-N,,,PFAS
138395016,"3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfinyl)propanoic acid",C(CS(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)O,DSUSHOGHCDVRGM-UHFFFAOYSA-N,FtSOPA,DTXSID30894131,PFAS
57257889,"2-methyl-2-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfanyl)propanoylamino]propane-1-sulfonic acid",CC(C)(CS(=O)(=O)O)NC(=O)CCSCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,DKVATWZCDNHYCW-UHFFFAOYSA-N,FtTAoS,DTXSID90892330,PFAS
139594731,"3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonyl)propanoic acid",C(CS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)O,DJIXHYAJLARCOP-UHFFFAOYSA-N,FtSO2PA,DTXSID501035900,PFAS
139594692,8:2 FtSO2AoS,CC(C)(CS(=O)(=O)O)NC(=O)CCS(=O)(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,DEONGGUSFBJEHM-UHFFFAOYSA-N,,DTXSID801035911,PFAS
53722673,"2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-[3-(methylamino)propyl]octanamide",CNCCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,CIHUQYRKXMQLDI-UHFFFAOYSA-N,,,PFAS
77797,"N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide",CCNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,CCEKAJIANROZEO-UHFFFAOYSA-N,,DTXSID1032646,PFAS
85976247,"3,4,4,5,5,6,6,7,7,8,8,8-Dodecafluorooct-2-enoic acid",C(=C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F)C(=O)O,BKOBFLVYTXYFQZ-UHFFFAOYSA-N,,DTXSID00892326,PFAS
14496522,"1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(2-hydroxyethyl)octane-1-sulfonamide",C(CO)NS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,AZJIYAIYELWMPL-UHFFFAOYSA-N,,DTXSID80892329,PFAS
138394405,"2-methyl-2-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfinyl)propanoylamino]propane-1-sulfonic acid",CC(C)(CS(=O)(=O)O)NC(=O)CCS(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,AQNDOJSDPBVJMJ-UHFFFAOYSA-N,FtSOAoS,DTXSID90892592,PFAS
3016044,8:2 FtS,C(CS(=O)(=O)O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,ALVYVCQIFHTIRD-UHFFFAOYSA-N,,DTXSID00192353,PFAS
14632790,5:3 FTCA,C(CC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)O,ABFCFCPCGMHSRX-UHFFFAOYSA-N,5:3 FtCA,DTXSID20874028,PFAS
163198785,"N-(3-Aminopropyl)-2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanamide",O=CCCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,KOYKTJBGTDDHHT-UHFFFAOYSA-N,,,PFAS
163198790,"2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-(2-hydroxyethyl)octanamide",O=CCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,VCWMBPUCYNETON-UHFFFAOYSA-N,,,PFAS
163198791,"3-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanoylamino)propanoic acid",O=C(O)CCNC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,WIPMNTYSSRXAND-UHFFFAOYSA-N,,,PFAS
163198784,"1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(3-oxopropyl)octane-1-sulfonamide",C(C=O)CNS(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,HMCSAZUDQOWRDW-UHFFFAOYSA-N,,,PFAS
163408226,"1,1,1,5,5,5-Hexafluoro-4-hydroxy-3-oxo-2,4-bis(trifluoromethyl)pentan-2-olate",C(=O)(C(C(F)(F)F)(C(F)(F)F)[O-])C(C(F)(F)F)(C(F)(F)F)O,NQERWJOAWSKYKJ-UHFFFAOYSA-N,,,
163408223,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxy-2-hydroperoxybenzenesulfonate",O=S([O-])(=O)c1ccc(cc1OO)O/C(=C(/C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F,MJNHTLSHQQMWTD-UHFFFAOYSA-M,,,
163408237,"4-[3,4,4,4-Tetrafluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-1-hydroxy-3-(trifluoromethyl)but-1-enoxy]benzenesulfonate",O=S([O-])(=O)c1ccc(OC(/O)=C(/C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)cc1,RECRNGWKCQHIMZ-UHFFFAOYSA-M,,,
163408265,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxy-3-hydroperoxybenzenesulfonate",O=S([O-])(=O)c1cc(OO)c(O/C(=C(/C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F)cc1,ZWMNIZJCWLACKU-UHFFFAOYSA-M,,,
163408215,"4-[3-[Difluoro(hydroxy)methyl]-3,4,4,4-tetrafluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-hydroxybutanoyl]oxybenzenesulfonate",O=S([O-])(=O)c1ccc(OC(=O)C(O)(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)O)cc1,KJOOPPPSVDEWRH-UHFFFAOYSA-M,,,
163408267,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxy-5-oxocyclohexa-1,3-diene-1-sulfonate",O=C1CC(=CC=C1O\C(=C(\C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F)S([O-])(=O)=O,ZYZGALCOFODUFO-UHFFFAOYSA-M,,,
163408195,"4-[4,4-Bis(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-3-hydroxydioxetan-3-yl]oxybenzenesulfonate",OC1(Oc2ccc(cc2)S([O-])(=O)=O)OOC1(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F,DQSZWKOBCCNSDY-UHFFFAOYSA-M,,,
163408262,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2,3-dihydroxy-4-(trifluoromethyl)pentan-2-yl]oxy-2-hydroxybenzenesulfonate",Oc1cc(ccc1S(=O)([O-])=O)OC(O)(C(O)(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F,ZDPZOLZKTVLQIZ-UHFFFAOYSA-M,,,
163408257,"4-[1,1,1,5,5,5-Hexafluoro-3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4-hydroxy-4-(trifluoromethyl)pent-2-en-2-yl]oxy-2-hydroxybenzenesulfonate",Oc1cc(ccc1S(=O)([O-])=O)O/C(=C(/C(O)(C(F)(F)F)C(F)(F)F)C(O)(C(F)(F)F)C(F)(F)F)C(F)(F)F,VQPUEHPJJALVKX-UHFFFAOYSA-M,,,
163408229,"4-[1,1,1,5,5,5-Hexafluoro-3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4-hydroxy-4-(trifluoromethyl)pent-2-en-2-yl]oxy-3-hydroxybenzenesulfonate",O=S([O-])(=O)c1cc(O)c(O/C(=C(/C(O)(C(F)(F)F)C(F)(F)F)C(O)(C(F)(F)F)C(F)(F)F)C(F)(F)F)cc1,OIIGVPHPJMRHCB-UHFFFAOYSA-M,,,
163408227,"[1,1,1,5,5,5-Hexafluoro-3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4-hydroxy-4-(trifluoromethyl)pent-2-en-2-yl] carbonate",O=C([O-])O\C(=C(/C(O)(C(F)(F)F)C(F)(F)F)C(O)(C(F)(F)F)C(F)(F)F)C(F)(F)F,OCHPDPULPJVESI-UHFFFAOYSA-M,,,
163408260,"4-[1,1,1,5,5,5-Hexafluoro-3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4-hydroxy-4-(trifluoromethyl)pent-2-en-2-yl]oxybenzenesulfonate",O=S([O-])(=O)c1ccc(O/C(=C(/C(O)(C(F)(F)F)C(F)(F)F)C(O)(C(F)(F)F)C(F)(F)F)C(F)(F)F)cc1,YPNAJOLGHADAFU-UHFFFAOYSA-M,,,
163408219,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxy-3-hydroxybenzenesulfonate",O=S([O-])(=O)c1cc(O)c(O/C(=C(/C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F)cc1,KNLGHLQRMPJMAL-UHFFFAOYSA-M,,,
163408239,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxy-2-hydroxybenzenesulfonate",O=S([O-])(=O)c1ccc(cc1O)O/C(=C(/C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F,RJPWWQOSLHTLBN-UHFFFAOYSA-M,,,
163408209,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxy-6-oxocyclohexa-1,3-diene-1-sulfonate",O=S([O-])(=O)C1=CC=C(O/C(=C(/C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F)CC1=O,JWHLEGSEINNPFA-UHFFFAOYSA-M,,,
163408199,"4-[1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2,3-dihydroxy-4-(trifluoromethyl)pentan-2-yl]oxy-3-hydroxybenzenesulfonate",[O-]S(=O)(=O)c1cc(O)c(OC(O)(C(O)(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F)cc1,HSUCVUMMOWEIDO-UHFFFAOYSA-M,,,
163408231,"4-[3,3-Bis(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-hydroxyoxiran-2-yl]oxy-3-hydroxybenzenesulfonate",FC(F)(F)C(F)(C1(OC1(O)Oc1ccc(cc1O)S(=O)(=O)[O-])C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F,OMHCXJVKIYEYKY-UHFFFAOYSA-M,,,
163408217,"1,1,1,5,5,5-Hexafluoro-3,3,4-trihydroxy-2,4-bis(trifluoromethyl)pentan-2-olate",FC(F)(F)C(O)(C(O)(O)C([O-])(C(F)(F)F)C(F)(F)F)C(F)(F)F,KLILKMJOEDUCQL-UHFFFAOYSA-N,,,
163408192,"(2,2,2-Trifluoro-1-hydroxyethyl) carbonate",FC(F)(F)C(O)OC(=O)[O-],CHSVLBAGSYHIQD-UHFFFAOYSA-M,,,
163408208,"3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl)propan-1-olate",FC(F)(F)C(O)(C[O-])C(F)(F)F,JVYKDAIZTBWEJT-UHFFFAOYSA-N,,,
163408244,"1,1,1,4,5,5,5-Heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-olate",FC(F)(F)C(F)(/C(=C(/[O-])\C(F)(F)F)/C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F,SDVYANXQEWXRTA-UHFFFAOYSA-M,,,
163408264,"1,1,1,2,4,5,5,5-Octafluoro-2,4-bis(trifluoromethyl)pentan-3-olate",FC(F)(F)C(F)(C([O-])C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F,ZFPOWMOLBJOCSX-UHFFFAOYSA-N,,,
163408190,"4-(2,2,2-Trifluoroethoxy)benzenesulfonate",O=S(=O)([O-])c1ccc(OCC(F)(F)F)cc1,CGBZVWQAEVAMAH-UHFFFAOYSA-M,,,
163408221,"4-Carboxyoxy-2,3,5,6-tetrahydroxybenzenesulfonate",Oc1c(O)c(OC(=O)O)c(O)c(O)c1S(=O)(=O)[O-],KUUUAHOAIMQSJB-UHFFFAOYSA-M,,,
163408253,"4-Carboxyoxy-2-hydroperoxy-3,5,6-trihydroxybenzenesulfonate",O=S(=O)([O-])c1c(O)c(O)c(OC(=O)O)c(O)c1OO,UPVGUMACLZFNHJ-UHFFFAOYSA-M,,,
163408255,"4-Carboxyoxy-3-hydroperoxy-2,5,6-trihydroxybenzenesulfonate",Oc1c(OO)c(OC(=O)O)c(O)c(O)c1S(=O)(=O)[O-],VDDMOKOMIADFKA-UHFFFAOYSA-M,,,
163408246,"(2,3,6-Trihydroxyphenyl) hydrogen carbonate",OC(=O)Oc1c(O)c(O)ccc1O,SLLKGOCZACATGP-UHFFFAOYSA-N,,,
163408225,"(2,3,4,6-Tetrahydroxyphenyl) hydrogen carbonate",OC(=O)Oc1c(O)c(O)c(O)cc1O,MPPWMCBIWQGKGQ-UHFFFAOYSA-N,,,
163408204,"(2,3,4,5,6-Pentahydroxyphenyl) hydrogen carbonate",OC(=O)Oc1c(O)c(O)c(O)c(O)c1O,IMFNAFFYABOJDO-UHFFFAOYSA-N,,,
163408203,"2,3,4,5,6-Pentahydroxybenzenesulfonic acid",Oc1c(O)c(O)c(O)c(O)c1S(=O)(=O)O,IEPQCSLNUZCJRF-UHFFFAOYSA-N,,,
101755896,"4-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxybenzenesulfonate",C1=CC(=CC=C1OC(=C(C(C(F)(F)F)(C(F)(F)F)F)C(C(F)(F)F)(C(F)(F)F)F)C(F)(F)F)S(=O)(=O)[O-],QGTOYUMAYUVGTO-UHFFFAOYSA-M,,,
53945206,"(2,6-dihydroxyphenyl) hydrogen carbonate",C1=CC(=C(C(=C1)O)OC(=O)O)O,JAPFWXFJJPJNKH-UHFFFAOYSA-N,,,
51401841,"1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-olate",C(C(F)(F)F)(C(F)(F)F)(O)[O-],GGDYXYSALGVDSV-UHFFFAOYSA-N,,,
23183370,"2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanoate",C(=O)(C(C(F)(F)F)(C(F)(F)F)F)[O-],YJDMCDWHXOSSHI-UHFFFAOYSA-M,,,
18612373,(4-sulfophenyl) carbonate,O=S([O-])(=O)c1ccc(OC(=O)O)cc1,RDJHUDQNEKGTSS-UHFFFAOYSA-M,,,
13269093,(2-hydroxyphenyl) hydrogen carbonate,C1=CC=C(C(=C1)O)OC(=O)O,PCCSWTQMTKSYSH-UHFFFAOYSA-N,,,
7145365,"3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoate",FC(F)(F)C(O)(C([O-])=O)C(F)(F)F,CMQUGOHGJUTDGZ-UHFFFAOYSA-M,,,
3010347,4-hydroxybenzenesulfonate,C1=CC(=CC=C1O)S(=O)(=O)[O-],FEPBITJSIHRMRT-UHFFFAOYSA-M,,,
588355,"benzene-1,2,3,4-tetrol",C1=CC(=C(C(=C1O)O)O)O,VERMEZLHWFHDLK-UHFFFAOYSA-N,,,
316180,"benzene-1,2,3,4,5-pentol",C1=C(C(=C(C(=C1O)O)O)O)O,RUFWIGMRKSSQJC-UHFFFAOYSA-N,,,
84468,"2,2,2-trifluoroacetate",C(=O)(C(F)(F)F)[O-],DTQVDTLACAAQTR-UHFFFAOYSA-M,,,
69102,"benzene-1,2,3,4,5,6-hexol",C1(=C(C(=C(C(=C1O)O)O)O)O)O,VWPUAXALDFFXJW-UHFFFAOYSA-N,,,
1057,"benzene-1,2,3-triol",C1=CC(=C(C(=C1)O)O)O,WQGWDDDVZFFDIG-UHFFFAOYSA-N,,,
996,phenol,C1=CC=C(C=C1)O,ISWSIDIOOBJBQZ-UHFFFAOYSA-N,,,
289,"benzene-1,2-diol",C1=CC=C(C(=C1)O)O,YCIMNLLNPGFGHC-UHFFFAOYSA-N,,,
163408207,"2-Chloro-1,1,2,3,3,3-hexafluoropropan-1-olate",FC(F)(F)C(Cl)(F)C(F)(F)[O-],JJSRGBOLRWIRAS-UHFFFAOYSA-N,,,
163408213,"1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-olate",FC(F)(OC(F)(F)C([O-])(F)C(F)(F)F)C(Cl)(F)C(F)(F)F,KFKPJXNBTDJTIH-UHFFFAOYSA-N,,,
163408194,"1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,3,3,3-hexafluoropropan-2-olate",FC(F)(OC(F)(F)C(Cl)(F)C(F)(F)F)C(F)(OC(F)(F)C(F)([O-])C(F)(F)F)C(F)(F)F,CZEYBDGAZVKJKJ-UHFFFAOYSA-N,,,
163408211,"1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,2,2,2-tetrafluoroethanolate",FC(F)(OC(F)([O-])C(F)(F)F)C(Cl)(F)C(F)(F)F,KFKKVGCHZDSKAF-UHFFFAOYSA-N,,,
163408247,"1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,2,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropan-2-olate",FC(OC(F)(F)C(Cl)(F)C(F)(F)F)(OC(F)(F)C(F)([O-])C(F)(F)F)C(F)(F)F,STQZSJCPQPDJFF-UHFFFAOYSA-N,,,
163408242,"1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,2,2,2-tetrafluoroethoxy]-1,2,2,2-tetrafluoroethanolate",FC(OC(F)(F)C(Cl)(F)C(F)(F)F)(OC([O-])(F)C(F)(F)F)C(F)(F)F,SBQCOQAHYJIUKJ-UHFFFAOYSA-N,,,
163408241,"1-[1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,3,3,3-hexafluoropropan-2-olate",FC(F)(OC(F)(F)C(Cl)(F)C(F)(F)F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)([O-])C(F)(F)F)C(F)(F)F)C(F)(F)F,RSBHTONXJQJJBF-UHFFFAOYSA-N,,,
163408197,"2-Chloro-1-[1-(difluoromethoxy)-1,2,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropane",FC(OC(F)(F)C(Cl)(F)C(F)(F)F)(O[C-](F)F)C(F)(F)F,HRSOGCIQYROFKC-UHFFFAOYSA-N,,,
163408205,"1-[1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,2,2,2-tetrafluoroethoxy]-1,2,2,2-tetrafluoroethoxy]-1,2,2,2-tetrafluoroethanolate",FC(F)(OC(F)(OC(F)(OC([O-])(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(Cl)(F)C(F)(F)F,IMIJRXYLVVSTPX-UHFFFAOYSA-N,,,
163408249,"1-[1-[1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,2,2,2-tetrafluoroethoxy]-1,2,2,2-tetrafluoroethoxy]-1,2,2,2-tetrafluoroethoxy]-1,2,2,2-tetrafluoroethanolate",FC(F)(OC(F)(OC(F)(OC(F)(OC(F)([O-])C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(Cl)(F)C(F)(F)F,UCZAGBRPXHHMJE-UHFFFAOYSA-N,,,
163408251,"1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,2,2,2-tetrafluoroethanolate",FC(F)(OC(F)(F)C(Cl)(F)C(F)(F)F)C(F)(OC(F)([O-])C(F)(F)F)C(F)(F)F,UMGSLTBDYFIFGH-UHFFFAOYSA-N,,,
163408201,"1-[1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,2,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropan-2-olate",FC(OC(F)(C(F)(F)F)C(F)(F)OC(F)(F)C(Cl)(F)C(F)(F)F)(OC(F)(F)C(F)([O-])C(F)(F)F)C(F)(F)F,ICTDYAXHOHINRN-UHFFFAOYSA-N,,,
163408233,"1-[1-[1-(2-Chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,2,2,2-tetrafluoroethoxy]-1,2,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropan-2-olate",FC(F)(OC(F)(OC(F)(OC(F)(F)C(F)([O-])C(F)(F)F)C(F)(F)F)C(F)(F)F)C(Cl)(F)C(F)(F)F,PTKXRHPTTUXXMY-UHFFFAOYSA-N,,,
102331873,"2-[1-[1-(2-chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-2,2-difluoroacetic acid",C(=O)(C(OC(C(OC(C(OC(C(C(F)(F)F)(F)Cl)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)O,JGRBOYAJYKVCOB-UHFFFAOYSA-N,,,
163325054,Chloro-perfluoro dimethyl triether undecanoic acid,FC(OC(F)(F)C(Cl)(F)C(F)(F)F)(OC(F)(F)C(F)(OC(F)(F)C(=O)O)C(F)(F)F)C(F)(F)F,GEXXADHKKGBLLH-UHFFFAOYSA-N,,,
163325055,Chloro-perfluoro dimethyl triether decanoic acid,FC(F)(OC(F)(OC(F)(OC(F)(F)C(Cl)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(=O)O,APCMCTBTFIFLHC-UHFFFAOYSA-N,,,
102331880,"2-[1-(2-chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-2,2-difluoroacetic acid",C(=O)(C(OC(C(OC(C(C(F)(F)F)(F)Cl)(F)F)(F)F)(C(F)(F)F)F)(F)F)O,JZLICTXOXFCCDU-UHFFFAOYSA-N,,,
102331878,"2-[1-[1-[1-(2-chloro-1,1,2,3,3,3-hexafluoropropoxy)-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-2,2-difluoroacetic acid",C(=O)(C(OC(C(OC(C(OC(C(OC(C(C(F)(F)F)(F)Cl)(F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(C(F)(F)F)F)(F)F)O,VWBHFMHYSNPDBL-UHFFFAOYSA-N,,,
163325038,Chloro-perfluoro tetramethyl pentaether tetradecanoic acid,FC(F)(OC(F)(OC(F)(OC(F)(OC(F)(OC(F)(F)C(=O)O)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(Cl)(F)C(F)(F)F,NWHFHIOCZRMXSU-UHFFFAOYSA-N,,,
163408235,Chloro-perfluoro trimethyl tetraether tetradecanoic acid,FC(OC(F)(C(F)(F)F)C(F)(F)OC(F)(F)C(Cl)(F)C(F)(F)F)(OC(F)(F)C(F)(OC(F)(F)C(=O)O)C(F)(F)F)C(F)(F)F,PUXLFZBNOPSOLP-UHFFFAOYSA-N,,,
163325034,Chloro-perfluoro trimethyl tetraether tridecanoic acid,FC(F)(OC(F)(OC(F)(OC(F)(F)C(F)(OC(F)(F)C(=O)O)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(Cl)(F)C(F)(F)F,KOCZMHDAWFCDQS-UHFFFAOYSA-N,,,
163325037,Chloro-perfluoro trimethyl tetraether dodecanoic acid,FC(F)(OC(F)(OC(F)(OC(F)(OC(F)(F)C(Cl)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(=O)O,HVFQTAZFUIOKCW-UHFFFAOYSA-N,,,
163408214,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-N-[3-[hydroxymethyl(methyl)amino]propyl]octane-1-sulfonamide",FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCS(=O)(=O)NCCCN(C)CO,KGQBAPGQJSLZSK-UHFFFAOYSA-N,,,PFAS
163408259,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-N-(3-hydroxypropyl)octane-1-sulfonamide",OCCCNS(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,WCTIWFIWSNWSMQ-UHFFFAOYSA-N,,,PFAS
102598504,6:2 fluorotelomer sulfonamido propyl methyl amine,CNCCCNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,ATVLXKVTLCASLQ-UHFFFAOYSA-N,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-N-[3-(methylamino)propyl]octane-1-sulfonamide",DTXSID001034707,PFAS
49869204,6:2 fluorotelomer sulfonamido propyl amine,C(CN)CNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,DLNFICFQUIYVBX-UHFFFAOYSA-N,"N-(3-aminopropyl)-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-sulfonamide",DTXSID101034724,PFAS
11669093,6:2 FTSAm,C(CS(=O)(=O)N)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,SQAFCSVGKMMETM-UHFFFAOYSA-N,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-sulfonamide",DTXSID30895724,PFAS
163324818,6:2 Fluorotelomer sulfonamido propionaldehyde,C(CNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C=O,JOZNZKNHTRLKIW-UHFFFAOYSA-N,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-N-(3-oxopropyl)octane-1-sulfonamide",,PFAS
163324817,"3-(3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctylsulfonylamino)propanoic acid",C(CNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)O,PFQMXWGWLBXTCF-UHFFFAOYSA-N,"3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfonylamino)propanoic acid",,PFAS
20734544,6:2 FTSA ion,C(CS(=O)(=O)[O-])C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,VIONGDJUYAYOPU-UHFFFAOYSA-M,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-sulfonate",DTXSID40873417,PFAS
85649173,6:2 FTUAL,C(=C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)F)C=O,IRFCYNBOXLFPAS-UHFFFAOYSA-N,"3,4,4,5,5,6,6,7,7,8,8,8-dodecafluorooct-2-enal",DTXSID40895533,PFAS
4086645,PFHpA ion,C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-],ZWBAMYVPMDSJGQ-UHFFFAOYSA-M,"2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanoate",DTXSID60892483,PFAS
15859812,5:2 ketone,CC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F,HWGNOHFZECDUBX-UHFFFAOYSA-N,"3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptan-2-one",DTXSID00578936,PFAS
18994450,5:2 sFTOH,CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)O,QOYNEVFKTZVANM-UHFFFAOYSA-N,"3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptan-2-ol",DTXSID80597206,PFAS
22182348,PFHxA ion,C(=O)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)[O-],PXUULQAPEKKVAH-UHFFFAOYSA-M,"2,2,3,3,4,4,5,5,6,6,6-undecafluorohexanoate",DTXSID20892484,PFAS
5111819,PFPeA ion,C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)[O-],CXZGQIAOTKWCDB-UHFFFAOYSA-M,"2,2,3,3,4,4,5,5,5-nonafluoropentanoate",DTXSID00892487,PFAS
101567675,5:3 FTUCA,C(=C/C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)\C(=O)O,UGMLUHQLUFIGNF-OWOJBTEDSA-N,"(E)-4,4,5,5,6,6,7,7,8,8,8-undecafluorooct-2-enoic acid",DTXSID401026580,PFAS
4342798,PFBA ion,C(=O)(C(C(C(F)(F)F)(F)F)(F)F)[O-],YPJUNDFVDDCYIH-UHFFFAOYSA-M,"2,2,3,3,4,4,4-heptafluorobutanoate",DTXSID80892480,PFAS
89927646,6:2 FTAA,CN(C)CCCNS(=O)(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,TZIPMEZQXPAKPK-UHFFFAOYSA-N,"N-[3-(dimethylamino)propyl]-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-sulfonamide",DTXSID30880433,PFAS
173976,"3-Amino-N,N,N-trimethyl-1-propanaminium",C[N+](C)(C)CCCN,PTTKEPPCFIOMEC-UHFFFAOYSA-N,,,
166001338,(Z)-dehydroxy-demethylene-dehydrofluoro-TFHFESE,[CH2]S/C(=C(/OC(C(C(F)(F)F)(F)F)(F)F)\F)/F,KRXBVVQHPXKQNV-NSCUHMNNSA-N,,,PFAS
1983,Acetaminophen,CC(=O)Nc1ccc(O)cc1,RZVAJINKPMORJF-UHFFFAOYSA-N,,,Drug
39763,Acetimidoquinone,CC(=O)N=C1C=CC(=O)C=C1,URNSECGXFRDEDC-UHFFFAOYSA-N,,,
77579,4-acetamido-2-chlorophenol,CC(=O)NC1=CC(=C(C=C1)O)Cl,JULKJDRBSRRBHT-UHFFFAOYSA-N,,,
130451,"Acetaminophen TP mz 301, RT 3.50",Oc1ccc(cc1c1cc(NC(C)=O)ccc1O)NC(C)=O,PHJCCQZHFLRCAA-UHFFFAOYSA-N,,,
163339065,"Acetaminophen TP mz 301, RT 4.17",CC(=O)NC1=CC=C(C=C1)OC2=C(C=CC(=C2)NC(=O)C)O,XGACQADXFCSLEB-UHFFFAOYSA-N,,,
166174208,"Acetaminophen TP mz 450, RT 4.80",Oc1c(cc(cc1Oc1ccc(NC(C)=O)cc1)NC(C)=O)Oc1ccc(NC(C)=O)cc1,MDCDDGWQBIHADH-UHFFFAOYSA-N,,,
166174213,"Acetaminophen TP mz 450, RT 3.91",Oc1c(cc(cc1c1cc(NC(C)=O)ccc1O)NC(C)=O)c1cc(NC(C)=O)ccc1O,YPYHANKVQVSZAK-UHFFFAOYSA-N,,,
166174201,"Acetaminophen TP mz 450, RT 4.25",CC(=O)Nc3cc(c2cc(cc(Oc1cc(NC(C)=O)ccc1O)c2O)NC(C)=O)c(O)cc3,CNFVGOLWYZMLJH-UHFFFAOYSA-N,,,
166174203,"Acetaminophen TP mz 599, RT 4.50",CC(=O)Nc1cc(c(O)cc1)c1cc(NC(C)=O)cc(c2cc(cc(Oc3ccc(NC(C)=O)cc3)c2O)NC(C)=O)c1O,DAIQBPXSVPPFOA-UHFFFAOYSA-N,,,
166174211,"Acetaminophen TP mz 335, RT 4.34",Oc1c(cc(cc1Cl)NC(C)=O)c1cc(NC(C)=O)ccc1O,UGUVYJGAOQLCRZ-UHFFFAOYSA-N,,,
166174210,"Acetaminophen TP mz 369, RT 4.81",Oc1c(cc(cc1Cl)NC(C)=O)c1cc(NC(C)=O)cc(Cl)c1O,PIYNAUYVMJGRPP-UHFFFAOYSA-N,,,
166174205,"Acetaminophen TP mz 484, RT 4.50",Oc1c(cc(cc1Cl)NC(C)=O)c1cc(NC(C)=O)cc(c2cc(NC(C)=O)ccc2O)c1O,FBKOEXHEBKYWAY-UHFFFAOYSA-N,,,
166174206,"Acetaminophen TP mz 337, RT 4.85 a",Clc1cc(ccc1Oc1cc(NC(C)=O)ccc1O)NC(C)=O,ITBKYRQFFMFTAS-UHFFFAOYSA-N,,,
166174207,"Acetaminophen TP mz 337, RT 4.85 b",Clc1cc(ccc1NC(C)=O)Oc1cc(NC(C)=O)ccc1O,JYJYUYGFHKRXJS-UHFFFAOYSA-N,,,
166174212,"Acetaminophen TP mz 486, RT 4.84 a",Clc1cc(ccc1Oc1cc(NC(C)=O)cc(c2cc(NC(C)=O)ccc2O)c1O)NC(C)=O,XVCUFNQXBWSZDN-UHFFFAOYSA-N,,,
166174200,"Acetaminophen TP mz 486, RT 4.84 b",Clc1cc(ccc1NC(C)=O)Oc1cc(NC(C)=O)cc(c2cc(NC(C)=O)ccc2O)c1O,CFNGOXKFBVZFDW-UHFFFAOYSA-N,,,
166174204,"Acetaminophen TP mz 518, RT 5.10",Oc1c(cc(cc1Cl)NC(C)=O)c1cc(NC(C)=O)cc(c2cc(NC(C)=O)cc(Cl)c2O)c1O,DRKIXHMLSAXVLI-UHFFFAOYSA-N,,,
166174209,"Acetaminophen TP mz 486, RT 5.02 a",Clc1cc(ccc1Oc1cc(NC(C)=O)cc(Oc2ccc(NC(C)=O)cc2)c1O)NC(C)=O,OUXVUYWXBURFDY-UHFFFAOYSA-N,,,
166174202,"Acetaminophen TP mz 486, RT 5.02 b",Clc1cc(ccc1NC(C)=O)Oc1cc(NC(C)=O)cc(Oc2ccc(NC(C)=O)cc2)c1O,CTTGLUOHXUDYPX-UHFFFAOYSA-N,,,
135828,Acetaminophen radical a,CC(=O)NC1=CC=C([O])C=C1,SXODILNMSPEPBT-UHFFFAOYSA-N,,,
166174054,4-acetamido-2-chlorophenol radical b,CC(=O)NC1=C[CH]C(=O)C(Cl)=C1,RFJHRKGNDBOXEV-UHFFFAOYSA-N,,,
166637318,(hydroxy-tert-butyl)-irgarol,C(O)C(C)(C)NC1=NC(=NC(=N1)NC2CC2)SC,HFCMSBLJLJOGGL-UHFFFAOYSA-N,,,
91590,Irgarol,CC(C)(C)NC1=NC(=NC(=N1)NC2CC2)SC,HDHLIWCXDDZUFH-UHFFFAOYSA-N,,,Agrochemical
57709734,4:2 FtTAoS,CC(C)(CS(=O)(=O)O)NC(=O)CCSCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F,VIHJAWYQCFERKN-UHFFFAOYSA-N,,DTXSID00892528,PFAS
91497,Galaxolide,CC1COCC2=CC3=C(C=C12)C(C(C3(C)C)C)(C)C,ONKNPOPIGWHAQC-UHFFFAOYSA-N,,,Musk
69131857,Galaxolidone,CC1COC(=O)C2=CC3=C(C=C12)C(C(C3(C)C)C)(C)C,PGMHPYRIXBRRQD-UHFFFAOYSA-N,,,
134206366,H-PFOS,O=S(C(F)([H])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(O)=O,AUKDNQZDSZEYCA-UHFFFAOYSA-N,,,
168509887,Hydroxy-6:2/6:2 diPAP,OC(COP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,JDGHPNPIEDPULE-UHFFFAOYSA-N,,,PFAS
168509892,6:2/6:2 FTMAP sulfoxide,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCSCC1(CS(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)COP(O)(=O)OC1,OYSUYMRFKUUMHB-UHFFFAOYSA-N,,,PFAS
168509895,6:2 monoFTMAP sulfone,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCS(=O)(=O)CC1(C)COP(O)(=O)OC1,QYPJSMXYWIRMLJ-UHFFFAOYSA-N,,,PFAS
168509884,6:2 monoFTMAP sulfoxide,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCS(=O)CC1(C)COP(O)(=O)OC1,IJTWKOFJLPDPRP-UHFFFAOYSA-N,,,PFAS
168509893,6:2/6:2 FTMAP sulfoxide-sulfone,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCS(=O)(=O)CC1(CS(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)COP(O)(=O)OC1,PCHTZKWWBMTNMQ-UHFFFAOYSA-N,,,PFAS
168509882,6:2/6:2 FTMAP sulfone,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCS(=O)(=O)CC1(CSCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)COP(O)(=O)OC1,HDAAYYKYMTUWKT-UHFFFAOYSA-N,,,PFAS
139596679,SF5-PFSA,C(C(C(C(C(F)(F)S(F)(F)(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F,PTFLVXXNVSLTOC-UHFFFAOYSA-N,,DTXSID301031788,PFAS
168509879,U-PFSA,C(=C(C(C(F)(F)S(=O)(=O)O)(F)F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F,BMIHYCXJXROAAO-UHFFFAOYSA-N,,,PFAS
168509890,U-SF5-PFSA,C(=C(/F)\S(=O)(=O)O)(/C(C(C(C(C(C(C(F)(F)S(F)(F)(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)\F,NLRUMJOYPPRIFY-UPHRSURJSA-N,,,PFAS
168509881,Ether-PFSA,O=S(C(F)(F)C(F)(F)C(F)(F)C(OC(F)(F)F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(O)=O,FRDXFFRWOXXDQG-UHFFFAOYSA-N,,,PFAS
168509894,di-U-PFSA,C(=C(\C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)/F)(/C(=C(/C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)\F)/F)\F,PIDRVQMVXCHCSF-ZPUQHVIOSA-N,,,PFAS
168509899,U-Ether-SF5,C(=C(/F)\OC(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(/C(C(C(C(F)(F)S(F)(F)(F)(F)F)(F)F)(F)F)(F)F)\F,ZFMFOUYKSHPZMG-UPHRSURJSA-N,,,PFAS
19027325,H2-PFOS,O=S(C([H])([H])C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(O)=O,FSVJFJWJQWUNCW-UHFFFAOYSA-N,,DTXSID301033691,PFAS
168509883,H-U-PFOS,O=S(/C([H])=C(F)/C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(O)=O,HUYNMWRJZUQGBR-UPHRSURJSA-N,,,PFAS
15564880,Cl-PFOS,C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F,TXNZTTQBKZRWQR-UHFFFAOYSA-N,,DTXSID30892935,PFAS
168509891,H3-U-PFOS,O=S(C([H])([H])C(F)([H])C(F)(F)C(F)(F)/C(F)=C(F)/C(F)(F)C(F)(F)F)(O)=O,NOYUOSMINGYRLW-ONEGZZNKSA-N,,,PFAS
168509885,H2-U-PFOS,O=S(C([H])(F)C(F)(F)C([H])(F)C(F)(F)/C(F)=C(F)/C(F)(F)C(F)(F)F)(O)=O,IKMVRXDXSWPVNW-OWOJBTEDSA-N,,,PFAS
168509889,H-di-unsaturated-PFOS,O=S(C(F)(F)C(F)(F)C(F)([H])/C(F)=C(F)/C(F)=C(F)/C(F)(F)F)(O)=O,LNGRXZMPSVBCIP-NRNIAZNESA-N,,,PFAS
168509886,PFSA-SF5-Ether,C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(C(C(C(F)(F)OS(F)(F)(F)(F)F)(F)F)(F)F)(F)F,JANYWYLVAKINMO-UHFFFAOYSA-N,,,PFAS
168509880,di-U-Ether-PFSA,O=S(C(F)(F)C(F)(F)C(F)(F)C(F)(F)/C(F)=C(F)/C(F)=C(F)/C(F)(C(F)(F)C(F)(OC(F)(F)F)F)F)(O)=O,DYGCZPZHGNZFFN-ZPUQHVIOSA-N,,,PFAS
168509897,U-Ether-PFSA,C(=C(/F)\OC(F)(F)F)(/C(C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)\F,VIRCPDKGBHOIBS-UPHRSURJSA-N,,,PFAS
168509888,Ether-PFCA,C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)OC(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O,KIJBPVGSTXPUKE-UHFFFAOYSA-N,,,PFAS
168509896,Hydroxy-6:2/8:2 diPAP,C(COP(=O)(O)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,TVWJSBMPGCPQEB-UHFFFAOYSA-N,,,PFAS
168509900,6:2/8:2 FTMAP sulfoxide,C(CSCC1(COP(=O)(O)OC1)CS(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,ZMTKQHCUHUPFKT-UHFFFAOYSA-N,,,PFAS
168509898,6:2/8:2 FTMAP disulfoxide/sulfone,C(CS(=O)CC1(COP(=O)(O)OC1)CS(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F,WJUIIURMQNYLKB-UHFFFAOYSA-N,,,PFAS
441300,abacavir,C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)[C@@H]4C[C@@H](C=C4)CO,MCGSCOLBFJQGHM-SCZZXKLOSA-N,,,Antimicrobial
135398513,acyclovir,C1=NC2=C(N1COCCO)N=C(NC2=O)N,MKUXAQIIEYXACX-UHFFFAOYSA-N,,,Antimicrobial
33613,amoxicillin,CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=C(C=C3)O)N)C(=O)O)C,LSQZJLSUYDQPKJ-NJBDSQKTSA-N,,,Antimicrobial
447043,azithromycin,CC[C@@H]1[C@@]([C@@H]([C@H](N(C[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)C)O)(C)O,MQTOSJVFKKJCRP-BICOPXKESA-N,,,Antimicrobial
54675777,chlortetracycline,C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O,DHPRQBPJLMKORJ-XRNKAMNCSA-N,,,Antimicrobial
84029,clarithromycin,CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OC)C)C)O)(C)O,AGOYDEPGAOXOCK-KCBOHYOISA-N,,,Antimicrobial
446598,clindamycin,CCC[C@@H]1C[C@H](N(C1)C)C(=O)N[C@@H]([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)O)O)O)[C@H](C)Cl,KDLRVYVGXIQJDK-AWPVFWJPSA-N,,,Antimicrobial
64139,efavirenz,C1CC1C#C[C@]2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F,XPOQHMRABVBWPR-ZDUSSCGKSA-N,,,Antimicrobial
60877,emtricitabine,C1[C@H](O[C@H](S1)CO)N2C=C(C(=NC2=O)N)F,XQSPYNMVSIKCOC-NTSWFWBYSA-N,,,Antimicrobial
12560,erythromycin,CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O,ULGZDMOVFRHVEP-RWJQBGPGSA-N,,,Antimicrobial
60825,lamivudine,C1[C@H](O[C@H](S1)CO)N2C=CC(=NC2=O)N,JTEGQNOMFQHVDC-NKWVEPMBSA-N,,,Antimicrobial
4173,metronidazole,CC1=NC=C(N1CCO)[N+](=O)[O-],VAOCPAMSLUNLGC-UHFFFAOYSA-N,,,Antimicrobial
4463,nevirapine,CC1=C2C(=NC=C1)N(C3=C(C=CC=N3)C(=O)N2)C4CC4,NQDJXKOVJZTUJA-UHFFFAOYSA-N,,,Antimicrobial
65028,oseltamivir,CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N)C(=O)OCC,VSZGPKBBMSAYNT-RRFJBIMHSA-N,,,Antimicrobial
54675779,oxytetracycline,C[C@@]1([C@H]2[C@@H]([C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O)O,OWFJMIVZYSDULZ-PXOLEDIWSA-N,,,Antimicrobial
5904,benzylpenicillin,CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C,JGSARLDLIJGVTE-MBNYWOFBSA-N,,,Antimicrobial
5215,sulfadiazine,C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N,SEEPANYCNGTZFQ-UHFFFAOYSA-N,,,Antimicrobial
5325,sulfamerazine,CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N,QPPBRPIAZZHUNT-UHFFFAOYSA-N,,,Antimicrobial
5327,sulfamethazine,CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C,ASWVTGNCAZCNNR-UHFFFAOYSA-N,,,Antimicrobial
5329,sulfamethoxazole,CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N,JLKIGFTWXXRPMT-UHFFFAOYSA-N,,,Antimicrobial
5336,sulfapyridine,C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N,GECHUMIMRBOMGK-UHFFFAOYSA-N,,,Antimicrobial
54675776,tetracycline,C[C@@]1([C@H]2C[C@H]3[C@@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O,NWXMGUDVXFXRIG-WESIUVDSSA-N,,,Antimicrobial
7547,triclocarban,C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)Cl)Cl,ICUTUKXCWQYESQ-UHFFFAOYSA-N,,,Antimicrobial
5564,triclosan,C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl,XEFQLINVKFYRCS-UHFFFAOYSA-N,,,Antimicrobial
56927907,carboxy-abacavir,C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)[C@@H]4C[C@@H](C=C4)C(=O)O,OCSMNHMMTKMVCP-APPZFPTMSA-N,,,
135508007,carboxy-acyclovir,C1=NC2=C(N1COCC(=O)O)N=C(NC2=O)N,MICNQLKUSOVNNG-UHFFFAOYSA-N,,,
135564758,3-(4-hydroxyphenyl)pyrazinol,OC1=CC=C(C=C1)C1=C(O)N=CC=N1,KNKDJXWCPVPHPA-UHFFFAOYSA-N,,,
132583458,amoxicillin penicilloic acid,CC1([C@@H](NC(S1)[C@@H](C(=O)O)NC(=O)[C@H](C2=CC=C(C=C2)O)N)C(=O)O)C,LHHKJQFIKHAUIA-BGJXXYSSSA-N,,,
71313270,amoxicillin penilloic acid,CC1([C@@H](NC(S1)CNC(=O)[C@@H](C2=CC=C(C=C2)O)N)C(=O)O)C,HLJHSXSJKLJNKE-SAIIYOCFSA-N,,,
12087378,amoxicillin-diketopiperazine-2'5',CC1([C@@H](N[C@H](S1)C2C(=O)NC(C(=O)N2)C3=CC=C(C=C3)O)C(=O)O)C,IIZCCQJEPBWGJU-YXLKDIQASA-N,,,
9987533,N-desmethyl azithromycin,CC[C@@H]1[C@@]([C@@H]([C@H](N(C[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)NC)O)(C)O)C)C)C)O)(C)O,FZYUKBLYECHAGN-HOQMJRDDSA-N,,,
9851445,descladinosyl azithromycin,CC[C@@H]1[C@@]([C@@H]([C@H](N(C[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)(C)O)C)C)C)O)(C)O,PXDYILJJHOVNLO-NZMWSZMZSA-N,,,
168720537,phosphorylated azithromycin,CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2OP(O)(O)=O)N(C)C)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O,RIQRARZRTBKKDH-GUWUEPHNSA-N,,,
54678407,4-epichlortetracycline,C[C@@]1([C@H]2C[C@H]3[C@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O,DHPRQBPJLMKORJ-XRZQSNOTSA-N,,,
54678405,iso-chlortetracycline,C[C@@]1(C2=C(C=CC(=C2C(=O)O1)O)Cl)[C@H]3C[C@H]4[C@@H](C(=O)C(=C([C@]4(C(=O)C3)O)O)C(=O)N)N(C)C,ZDCFZNSICAQKSV-AXVXPIMKSA-N,,,
84020,14-hydroxy-clarithromycin,C[C@@H]1C[C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](C(=O)O[C@@H]([C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]2(C)OC)C)C)O)(C)O)C(C)O)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)OC)C)O)N(C)C,BLPFDXNVUDZBII-KNPZYKNQSA-N,,,
11072636,N'-demethyl clarithromycin,CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)NC)O)(C)OC)C)C)O)(C)O,CIJTVUQEURKBDL-RWJQBGPGSA-N,,,
73046007,clindamycin sulfoxide,CCCC1CC(N(C1)C)C(=O)NC(C2C(C(C(C(O2)S(=O)C)O)O)O)C(C)Cl,XSLGFIQRVCXUEU-UHFFFAOYSA-N,,,
46781323,"8,14-dihydroxy-efavirenz",C1CC1(C#CC2(C3=C(C(=CC(=C3)Cl)O)NC(=O)O2)C(F)(F)F)O,WILFXLMJFSKQRP-UHFFFAOYSA-N,,,
56637813,carboxy-emtricitabine,C1[C@H](O[C@H](S1)C(=O)O)N2C=C(C(=NC2=O)N)F,GQHACZWRCOKKIZ-MHTLYPKNSA-N,,,
10038386,emtricitabine S-oxide,C1[C@H](O[C@H](S1=O)CO)N2C=C(C(=NC2=O)N)F,DMOMZPWPIDCLMB-YGFFCSEESA-N,,,
83949,anhydro-erythromycin,CC[C@@H]1[C@@]2([C@@H]([C@H]([C@@]3(O2)[C@@H](C[C@@](O3)([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]4C[C@@]([C@H]([C@@H](O4)C)O)(C)OC)C)O[C@H]5[C@@H]([C@H](C[C@H](O5)C)N(C)C)O)C)C)C)O)C,YKAVHPRGGAUFDN-JTQLBUQXSA-N,,,
83954,erythromycin A enol ether,CC[C@@H]1[C@@]([C@@H]([C@H](C2=C(C[C@@](O2)([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)OC)C)O[C@H]4[C@@H]([C@H](C[C@H](O4)C)N(C)C)O)C)C)C)O)(C)O,JFVYXJKGJMUGRG-KJPZRSJGSA-N,,,
6537896,erythromycin oxime,CC[C@@H]1[C@@]([C@@H]([C@H](/C(=N/O)/[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O,KYTWXIARANQMCA-ZTILBQITSA-N,,,
71749724,carboxy-lamivudine,C1[C@@H](O[C@@H](S1)C(=O)O)N2C=CC(=NC2=O)N,PIIRVEZNDVLYQA-VDTYLAMSSA-N,,,
121858,hydroxy metronidazole,C1=C(N(C(=N1)CO)CCO)[N+](=O)[O-],AEHPOYAOLCAMIU-UHFFFAOYSA-N,,,
453338,12-hydroxy-nevirapine,C1CC1N2C3=C(C=CC=N3)C(=O)NC4=C(C=CN=C42)CO,SEBABOMFNCVZGF-UHFFFAOYSA-N,,,
449381,oseltamivir carboxylate,CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N)C(=O)O,NENPYTRHICXVCS-YNEHKIRRSA-N,,,
54678403,4-epioxytetracycline,C[C@@]1([C@H]2[C@@H]([C@H]3[C@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O)O,OWFJMIVZYSDULZ-DVJPNYBFSA-N,,,
71460627,apo-oxytetracycline,CC1=C2C=CC=C(C2=C(C3=C1[C@@H](OC3=O)[C@H]4[C@@H](C(=C(C(=O)[C@H]4O)C(=O)N)O)N(C)C)O)O,DRKMHDAKULCOKQ-SECMTKEISA-N,,,
13751905,benzylpenicilloaldehyde,C1=CC=C(C=C1)CC(=O)NCC=O,ZBDOVHVJWVWSPQ-UHFFFAOYSA-N,,,
98994,benzylpenicilloic acid,CC1(C(NC(S1)C(C(=O)O)NC(=O)CC2=CC=CC=C2)C(=O)O)C,HCYWNSXLUZRKJX-UHFFFAOYSA-N,,,
253302,benzylpenillic acid,CC1(C(N2C(S1)C(N=C2CC3=CC=CC=C3)C(=O)O)C(=O)O)C,PSPRNQOVLYLHSA-UHFFFAOYSA-N,,,
2825766,benzylpenilloic acid,CC1([C@@H](N[C@H](S1)CNC(=O)CC2=CC=CC=C2)C(=O)O)C,LRWFMQCGNBOTQP-OLZOCXBDSA-N,,,
13751903,isopenillic acid,CC(C)(S)[C@H](C(O)=O)N1C=C(N=C1CC1C=CC=CC=1)C(O)=O,QLTUFLACBYWAET-ZDUSSCGKSA-N,,,
74368,4-formamido-N-(2-pyrimidinyl)benzenesulfonamide,CNS(=O)(=O)C1=CC=C(N)C=C1,OISQSDKFWKJEBA-UHFFFAOYSA-N,,,
101436677,4-amino-N-methyl-benzenesulfonamide,O=CNC1=CC=C(C=C1)S(=O)(=O)NC1=NC=CC=N1,OVELYWMMDNFICW-UHFFFAOYSA-N,,,
462434,5-hydroxy-sulfadiazine,NC1=CC=C(C=C1)S(=O)(=O)NC1=NC=C(O)C=N1,VBMYFGQAZZYDIY-UHFFFAOYSA-N,,,
64952,N-acetyl-sulfadiazine,CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=NC=CC=N1,NJIZUWGMNCUKGU-UHFFFAOYSA-N,,,
7371,benzensulfonic acid,C1=CC=C(C=C1)S(=O)(=O)O,SRSXLGNVWSONIS-UHFFFAOYSA-N,,,
67181,N-acetyl-sulfamerazine,CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C,PHFJZKMLXDFUNB-UHFFFAOYSA-N,,,
66855,N-acetyl-sulfamethazine,CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C,LJKAKWDUZRJNPJ-UHFFFAOYSA-N,,,
43154654,4-N-methyl-sulfamethoxazole,CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC,ZRXDSRHCGYXVTI-UHFFFAOYSA-N,,,
168720538,4-amino-N-[(1E)-1-amino-3-oxobut-1-en-1-yl]-2-hydroxybenzene-1-sulfonamide,CC(=O)\C=C(/N)NS(=O)(=O)C1=C(O)C=C(N)C=C1,SDUSBQGOWFLSPH-ONNFQVAWSA-N,,,
168720535,4-amino-N-[(1E)-1-amino-3-oxobut-1-en-1-yl]benzene-1-sulfonamide,CC(=O)\C=C(/N)NS(=O)(=O)C1=CC=C(N)C=C1,AQWFGIMMOKOFEB-UXBLZVDNSA-N,,,
125483,4-nitroso-sulfamethoxazole,CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N=O,GHNQGDUYHCZZPT-UHFFFAOYSA-N,,,
162661006,N-dimethyl-sulfamethoxazole,CN(C)C1=CC=C(C=C1)S(=O)(=O)NC1=NOC(C)=C1,HLKGYQLPLBQMTR-UHFFFAOYSA-N,,,
75213081,sulfamethoxazole beta-D-glucuronide,CC1=CC(=NO1)N(C2C(C(C(C(O2)C(=O)O)O)O)O)S(=O)(=O)C3=CC=C(C=C3)N,BLFOMTRQSZIMKK-UHFFFAOYSA-N,,,
65280,N-acetyl-sulfamethoxazole,CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=NOC(C)=C1,GXPIUNZCALHVBA-UHFFFAOYSA-N,,,
168720536,carboxy-sulfamethoxazole,CC(=O)C1=CC(NS(=O)(=O)C2=CC=C(N)C=C2)=NO1,IKRDIJZZCVWWKQ-UHFFFAOYSA-N,,,
125378864,5-[4-(acetylamino)benzenesulf-onyloxy]sulfapyridine acetate,CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=CC=C(OS(=O)(=O)C2=CC=C(NC(C)=O)C=C2)C=N1,JPIUMBXLXMOUNV-UHFFFAOYSA-N,,,
148510,5-hydroxy-sulfapyridine,NC1=CC=C(C=C1)S(=O)(=O)NC1=CC=C(O)C=N1,XMCHHHBDBWYWSU-UHFFFAOYSA-N,,,
58638,N-acetyl-sulfapyridine,CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=N2,CYLYVXPHAQLXFG-UHFFFAOYSA-N,,,
54678401,4-epianhydrotetracycline,CC1=C2C=CC=C(C2=C(C3=C1C[C@H]4[C@H](C(=O)C(=C([C@]4(C3=O)O)O)C(=O)N)N(C)C)O)O,KTTKGQINVKPHLY-WPINSWFRSA-N,,,
54682506,4-epitetracycline,C[C@@]1([C@H]2C[C@H]3[C@H](C(=O)C(=C([C@]3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O,NWXMGUDVXFXRIG-PMXORCKASA-N,,,
51527838,anhydrotetracycline,CC1=C2C=CC=C(C2=C(C3=C1C[C@H]4[C@@H](C(=O)C(=C([C@]4(C3=O)O)O)C(=O)N)N(C)C)O)O,KTTKGQINVKPHLY-DOCRCCHOSA-N,,,
95783,"1,3-bis(3,4-dichlorophenyl)urea",C1=CC(=C(C=C1NC(=O)NC2=CC(=C(C=C2)Cl)Cl)Cl)Cl,ZDPIZPXVHVYTOK-UHFFFAOYSA-N,,,
7595,carbanilide,C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2,GWEHVDNNLFDJLR-UHFFFAOYSA-N,,,
791964,dichlorocarbanilide,C1=CC(=CC(=C1)Cl)NC(=O)NC2=CC=C(C=C2)Cl,WEGKFRNBRWVJKT-UHFFFAOYSA-N,,,
627458,methyl triclosan,COC1=C(C=CC(=C1)Cl)OC2=C(C=C(C=C2)Cl)Cl,NLYDHBBTVWMLFD-UHFFFAOYSA-N,,,
7222,Benzothiazole,C1=CC=C2C(=C1)N=CS2,IOJUPLGTWVMSFF-UHFFFAOYSA-N,,,Benzothiazole
13625,Benzothiazolone,C1=CC=C2C(=C1)N=C(O)S2,YEDUAINPPJYDJZ-UHFFFAOYSA-N,,,Benzothiazole
30692,2-(Thiocyanomethylthio)benzothiazole,C1=CC=C2C(=C1)N=C(SCSC#N)S2,TUBQDCKAWGHZPF-UHFFFAOYSA-N,,,
697993,2-Mercaptobenzothiazole,C1=CC=C2C(=C1)N=C(S)S2,YXIWHUQXZSMYRE-UHFFFAOYSA-N,,,Benzothiazole
11989,2-(Methylthio)benzothiazole,C1=CC=C2C(=C1)N=C(SC)S2,UTBVIMLZIRIFFR-UHFFFAOYSA-N,,,
30647,Benzothiazole-2-sulfonic acid,C1=CC=C2C(=C1)N=C(S(=O)(=O)O)S2,ZCXGMSGCBDSEOY-UHFFFAOYSA-N,,,Benzothiazole
8447,"2,2'-Dithiobis(benzothiazole)",C1=CC=C2C(=C1)N=C(S2)SSC3=NC4=CC=CC=C4S3,AFZSMODLJJCVPP-UHFFFAOYSA-N,,,
11491998,"2,6-Dihydroxybenzothiazole",C1=C(O)C=C2C(=C1)N=C(O)S2,IOAXKKHMBVTXJX-UHFFFAOYSA-N,,,
4171,Metoprolol,CC(C)NCC(COC1=CC=C(C=C1)CCOC)O,IUBSYMUCCVWXPE-UHFFFAOYSA-N,,,Drug
2206,Phenazone,CC1=CC(=O)N(N1C)C2=CC=CC=C2,VEQOALNAAJBPNY-UHFFFAOYSA-N,,,Drug
10105079,N-Desisopropyl metoprolol,NCC(COC1=CC=C(C=C1)CCOC)O,XJWXVDJGNOHFLR-UHFFFAOYSA-N,,,
8479,Sulfanilic acid,Nc1ccc(cc1)S(O)(=O)=O,HVBSAKJJOYLTQU-UHFFFAOYSA-N,,,
66172,3-Amino-5-methylisoxazole,CC1=CC(=NO1)N,FKPXGNGUVSHWQQ-UHFFFAOYSA-N,,,
6115,Aniline,C1=CC=C(C=C1)N,PAYRUJLWNCNPSJ-UHFFFAOYSA-N,,,
7671,Formanilide,C1=CC=C(C=C1)NC=O,DYDNPESBYVVLBO-UHFFFAOYSA-N,,,
91755,Flurtamone,CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F,NYRMIJKDBAQCHC-UHFFFAOYSA-N,,DTXSID5058228,Agrochemical
86429,Flufenacet,CC(C)N(C1=CC=C(C=C1)F)C(=O)COC2=NN=C(S2)C(F)(F)F,IANUJLZYFUDJIH-UHFFFAOYSA-N,,DTXSID2032552,Agrochemical
11556911,Tembotrione,CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)C2C(=O)CCCC2=O)Cl)COCC(F)(F)F,IUQAXCIUEPFPSF-UHFFFAOYSA-N,,DTXSID5047037,Agrochemical
11158353,Fluopyram,C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F,KVDJTXBXMWJJEF-UHFFFAOYSA-N,,DTXSID9058151,Agrochemical
11784975,Penoxsulam,COC1=CN=C(N2C1=NC(=N2)NS(=O)(=O)C3=C(C=CC=C3OCC(F)F)C(F)(F)F)OC,SYJGKVOENHZYMQ-UHFFFAOYSA-N,,DTXSID0034803,Agrochemical
16723172,Sulfoxaflor,CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C,ZVQOOHYFBIDMTQ-UHFFFAOYSA-N,,DTXSID0074687,Agrochemical
11571392,Saflufenacil,CC(C)N(C)S(=O)(=O)NC(=O)C1=CC(=C(C=C1Cl)F)N2C(=O)C=C(N(C2=O)C)C(F)(F)F,GNHDVXLWBQYPJE-UHFFFAOYSA-N,,DTXSID9058072,Agrochemical
11657899,Tritosulfuron,COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(F)(F)F)C(F)(F)F,KVEQCVKVIFQSGC-UHFFFAOYSA-N,,DTXSID9057975,Agrochemical
68617,Sertraline,CN[C@H]1CC[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl,VGKDLMBJGBXTGI-SJCJKPOMSA-N,SER,,Drug
3334,Fenbendazole,COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC=C3,HDDSHPAODJUKPD-UHFFFAOYSA-N,FBZ,,Drug
6428309,Acetyl sertraline,CC(=O)N(C)[C@@H]1CC[C@@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl,VVNSLNBJUXUABM-AUUYWEPGSA-N,Acetyl SER,,
56626156,N-Hydroxy sertraline,CN([C@H]1CC[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl)O,YBWRFMYMDBDCLH-SJCJKPOMSA-N,,,
1474501,Sertraline ketone,C1CC(=O)C2=CC=CC=C2[C@@H]1C3=CC(=C(C=C3)Cl)Cl,JGMBHJNMQVKDMW-NSHDSACASA-N,SER ketone,,
6305585,Sertraline oxime,C1C/C(=N\O)/C2=CC=CC=C2C1C3=CC(=C(C=C3)Cl)Cl,CGIUOCJZIYTDRG-KNTRCKAVSA-N,SER oxime,,
172419501,Acetyl hydroxy sertraline,O=C(NC1C=2C=CC=CC2C(C3=CC=C(Cl)C(Cl)=C3)C(O)C1)C,AFPFWOFZCHEAOF-UHFFFAOYSA-N,Acetyl hydroxy SER,,
18642483,N-Methylsertraline,CN(C)[C@H]1CC[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl,LTKRQOGLVNJKBK-UGSOOPFHSA-N,N-Methyl SER,,
40854,Oxfendazole,COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)C3=CC=CC=C3,BEZZFPOZAYTVHN-UHFFFAOYSA-N,OxFBZ,,
162136,Fenbendazole sulfone,COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)C3=CC=CC=C3,UAFDGCOOJPIAHN-UHFFFAOYSA-N,FBZ sulfone,,
172419506,Oxfendazole glucoside,O=C(OC)NC1NC2=CC=C(C=C2N1C3OC(CO)C(O)C(O)C3O)S(=O)C=4C=CC=CC4,MHIURUPBJYNAQH-UHFFFAOYSA-N,OxFBZ glucoside,,
172419507,Fenbendazole glucoside,O=C(OC)NC1NC2=CC=C(SC=3C=CC=CC3)C=C2N1C4OC(CO)C(O)C(O)C4O,NFEJFNUHUACEIA-UHFFFAOYSA-N,FBZ glucoside,,
172419511,Fenbendazole sulfone glucoside,O=C(OC)NC1NC2=CC=C(C=C2N1C3OC(CO)C(O)C(O)C3O)S(=O)(=O)C=4C=CC=CC4,PQJCWVMAXDVOQU-UHFFFAOYSA-N,FBZ sulfone glucoside,,
172419520,FOSA glucoside,O=S(=O)(NOC1C(O)COC(O)C1O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,ZXXWKIPYPAQAPJ-UHFFFAOYSA-N,,,
172419512,FOSA lactate,O=C(ONS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)C,QKOHFDUXYJBFQQ-UHFFFAOYSA-N,,,
6623,Bisphenol A,CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O,IISBACLAFKSPIT-UHFFFAOYSA-N,BPA,,
8456,tert-Butyl-4-hydroxyanisole,CC(C)(C)C1=C(C=CC(=C1)OC)O,MRBKEAMVRSLQPH-UHFFFAOYSA-N,BHA,,
7311,"2,4-di-tert-butyl-phenol",CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C,ICKWICRCANNIBI-UHFFFAOYSA-N,DBP,,
85069,"bis(4-(1,1,3,3-Tetramethylbutyl)phenyl)amine ",CC(C)(C)CC(C)(C)C1=CC=C(C=C1)NC2=CC=C(C=C2)C(C)(C)CC(C)(C)C,GQBHYWDCHSZDQU-UHFFFAOYSA-N,C8C8,,
14565,4-Amino-4'-hydroxybiphenyl,C1=CC(=CC=C1C2=CC=C(C=C2)O)N,LQZZZAFQKXTFKH-UHFFFAOYSA-N,,,
8764,4-Phenoxyaniline,C1=CC=C(C=C1)OC2=CC=C(C=C2)N,WOYZXEVUWXQVNV-UHFFFAOYSA-N,,,
31208,4-Anilinophenol,C1=CC=C(C=C1)NC2=CC=C(C=C2)O,JTTMYKSFKOOQLP-UHFFFAOYSA-N,,,
172643731,BPA-C_ortho-C'_ortho-SMX,O=S(=O)(Nc1noc(C)c1)c1ccc(N)c(c1)c1cc(ccc1O)C(C)(C)c1ccc(O)cc1,DTJQREBNLDTCGK-UHFFFAOYSA-N,BPA-Cortho-C'ortho-SMX,,
172643732,BHA-C_ortho-C'_para-6PPD,COc1cc(c(O)c(c1)c1ccc(Nc2ccc(NC(C)CC(C)C)cc2)cc1)C(C)(C)C,HJGBJGUUFRRATC-UHFFFAOYSA-N,BHA-Cortho-C'para-6PPD,,
172643733,DBP-C_ortho-C'_ortho-C8C8,CC(C)(C)c1cc(c(O)c(c1)c1cc(ccc1Nc1ccc(cc1)C(C)(C)CC(C)(C)C)C(C)(C)CC(C)(C)C)C(C)(C)C,HTFVVAMALMQEFW-UHFFFAOYSA-N,DBP-Cortho-C'ortho-C8C8,,
172643734,TCS-C_ortho-C'_ortho-TCC,O=C(Nc1ccc(Cl)cc1c1c(O)c(ccc1Cl)Oc1ccc(Cl)cc1Cl)Nc1ccc(Cl)c(Cl)c1,CAWJHCNZWVFAPL-UHFFFAOYSA-N,TCS-Cortho-C'ortho-TCC,,
176,acetic acid,CC(O)=O,QTBSBXVTEAMEQO-UHFFFAOYSA-N,,,
4093,methacrylic acid,CC(=C)C(O)=O,CERQOIWHTDAKMF-UHFFFAOYSA-N,,,
5281,stearic acid,CCCCCCCCCCCCCCCCCC(O)=O,QIQXTHQIDYTFRH-UHFFFAOYSA-N,,,
6581,acrylic acid,OC(=O)C=C,NIXOWILDQLNWCW-UHFFFAOYSA-N,,,
9883,Trifluoro(trifluoromethyl)oxirane,FC(F)(F)C1(F)OC1(F)F,PGFXOWRDDHCDTE-UHFFFAOYSA-N,HFPO,,PFAS
11204,Acetyl fluoride ,CC(F)=O,JUCMRTZQCZRJDC-UHFFFAOYSA-N,,,
67632,heptafluorobutanoyl fluoride,FC(=O)C(F)(F)C(F)(F)C(F)(F)F,YYXWJNBPHDUWJP-UHFFFAOYSA-N,,,PFAS
67717,Trifluoroacetamide ,NC(=O)C(F)(F)F,NRKYWOKHZRQRJR-UHFFFAOYSA-N,,,PFAS
67907,"2,2,3,3,3-pentafluoropropanal",[H]C(=O)C(F)(F)C(F)(F)F,IRPGOXJVTQTAAN-UHFFFAOYSA-N,,,PFAS
70083,10:2 FTOH,OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,FLXYIZWPNQYPIT-UHFFFAOYSA-N,,,PFAS
74322,N-Ethyl-N-(2-hydroxyethyl)perfluorooctane sulfonamide,CCN(CCO)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,HUFHNYZNTFSKCT-UHFFFAOYSA-N,,,PFAS
74888,"1H,1H,2H,2H-Perfluorooctyl iodide",FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCI,NVVZEKTVIXIUKW-UHFFFAOYSA-N,6:2 FTI,,PFAS
93767,10:2 Fluorotelomer dihydrogen phosphate,OP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,MCYKSXMNSXNCIY-UHFFFAOYSA-N,10:2 monoPAP,,PFAS
94258,"1,1,1,2,2,3,3-heptafluoro-3-(1,2,2,2-tetrafluoroethoxy)propane",FC(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F,CUTPKDUMZWIJKT-UHFFFAOYSA-N,,,PFAS
110548,Perfluorooctanesulfinic acid,OS(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,DFCYBFLXCKGZML-UHFFFAOYSA-N,PFOSI,,PFAS
114481,Hexafluoropropylene oxide dimer acid,OC(=O)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F,CSEBNABAWMZWIF-UHFFFAOYSA-N,HFPO-DA,,PFAS
118688,2-(N-(Perfluorobutylsulfonyl)-N-methylamino)ethanol,CN(CCO)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,DSRUAYIFDCHEEV-UHFFFAOYSA-N,,,PFAS
119747,8:2 Fluorotelomer acrylate,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)C=C,QUKRIOLKOHUUBM-UHFFFAOYSA-N, 8:2 FTAc,,PFAS
136533,hexafluorocyclobutan-1-one,FC1(F)C(=O)C(F)(F)C1(F)F,OKMQQXIEPRGARV-UHFFFAOYSA-N,,,PFAS
160606,8:2 Fluorotelomer methacrylate,CC(=C)C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,HBZFBSFGXQBQTB-UHFFFAOYSA-N, 8:2 FTMAc,,PFAS
160613,"1,2,2,2-Tetrafluoroethanesulfonyl fluoride",FC(C(F)(F)F)S(F)(=O)=O,KQAPHIQIAHGITH-UHFFFAOYSA-N,,,PFAS
410461,2-acetamidobenzenesulfonic acid,CC(=O)NC1=C(C=CC=C1)S(O)(=O)=O,KCMKIDORSDPITL-UHFFFAOYSA-N,,,
2774909,3:3 FTCA,OC(=O)CCC(F)(F)C(F)(F)C(F)(F)F,ISFKSWMQWIRDNC-UHFFFAOYSA-N,,,PFAS
2775798,"1,1,1,2,2,3,3,4,4-nonafluorobutane",[H]C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,ZQTIKDIHRRLSRV-UHFFFAOYSA-N,,,PFAS
2782609,"2,3,3,3-tetrafluoropropanoic acid",OC(=O)C(F)C(F)(F)F,GPKYZQLMEPJAGJ-UHFFFAOYSA-N,,,PFAS
2833812,"3,3,3-trifluoro-2,2-dihydroxypropanoic acid",OC(=O)C(O)(O)C(F)(F)F,KWLJNSLMDANMQG-UHFFFAOYSA-N,,,PFAS
3625095,8:2 Fluorotelomer stearate monoester,CCCCCCCCCCCCCCCCCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,VXEFJEZHABKUFT-UHFFFAOYSA-N,,,PFAS
5375714,"(1E)-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-1-iodooct-1-ene",[H]\C(I)=C/C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,WDWNMIBWWPZNJK-OWOJBTEDSA-N,,,PFAS
5708519,3:3 FTUCA,C(=C/C(C(C(F)(F)F)(F)F)(F)F)\C(=O)O,KRBNWYYINLFKND-OWOJBTEDSA-N,3:3 FTUCA,,PFAS
11035876,6:2 sFTOH,[H]C(C)(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,HYSSZDTUULNWLC-UHFFFAOYSA-N,,,PFAS
11723125,"3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptan-1-ol",OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,NPOAVCPGPRUNOX-UHFFFAOYSA-N,,,PFAS
11759813,Perfluoroheptanal,[H]C(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,YYYONDXERNIFKX-UHFFFAOYSA-N,,,PFAS
12574726,"1-chloro-1,2,2,2-tetrafluoroethanesulfonic acid",OS(=O)(=O)C(F)(Cl)C(F)(F)F,XYMXFNHFPLQXTR-UHFFFAOYSA-N,,,PFAS
12603809,Methyl Pentadecafluoroheptyl Ketone ,CC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,LFMZSQGESVNRLL-UHFFFAOYSA-N,7:2 FT Ketone,,PFAS
12643061,"1-chloro-1,2,2,2-tetrafluoroethanesulfonyl fluoride",FC(F)(F)C(F)(Cl)S(F)(=O)=O,GWIPXKUCVLSQMA-UHFFFAOYSA-N,,,PFAS
13081654,7:2 sFluorotelomer alcohol,CC(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,LWKNIRKCYPKSGM-UHFFFAOYSA-N,7:2 sFTOH,,PFAS
13204834,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-1-iodooctan-2-ol",OC(CI)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,PJKIPGCITXQLEX-UHFFFAOYSA-N,,,PFAS
13319073,"2,3,3,3-Tetrafluoropropanoyl fluoride",FC(C(F)=O)C(F)(F)F,OVCHOVMROGWUGQ-UHFFFAOYSA-N,,,PFAS
13433166,"2,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooct-2-enoic acid ",OC(=O)C(\F)=C(/F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,UWPJKAFMMWYWOX-OWOJBTEDSA-N,uPFOA,,PFAS
14169491,bis(nonafluorobutyl)phosphinic acid ,OP(=O)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,WAZIDHPTVNFDQG-UHFFFAOYSA-N,,,PFAS
14250578,6:2 Fluorotelomer phosphate monoester,OP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,FZTRDYSPWWJCOF-UHFFFAOYSA-N,6:2 monoPAP,,PFAS
14452717,"1,1,2,2,3,3,4,4,4-nonafluorobutylphosphonic acid",OP(O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,AUBOIAPNLUHLAF-UHFFFAOYSA-N,,,PFAS
14914909,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1,2-diol",OCC(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,OCFQEBCFMDZJGI-UHFFFAOYSA-N,,,PFAS
17763196,5:2 FTCA,OC(=O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,KDHKNZMUAYFSHV-UHFFFAOYSA-N,,,PFAS
20501210,"1,1,2-trifluoropropan-1-ol",[H]C(C)(F)C(O)(F)F,OWICEKPXYVPPMH-UHFFFAOYSA-N,,,PFAS
20575561,"1,2,2,3,3,4,4-heptafluorocyclobutanol ",OC1(F)C(F)(F)C(F)(F)C1(F)F,LVIUTZNUWNBUCA-UHFFFAOYSA-N,,,PFAS
22286931,"(N-methyl1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctanesulfonamido)acetic acid",CN(CC(O)=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,QNDHIRFIMVNHBN-UHFFFAOYSA-N,,,PFAS
23500129,2-fluoropropanoyl fluoride,[H]C(C)(F)C(F)=O,INGFLBLMEBWCNV-UHFFFAOYSA-N,,,
53438102,"1,2,2,2-tetrafluoroethanesulfonic acid",OS(=O)(=O)C(F)C(F)(F)F,DFXIGNRYXLVEDF-UHFFFAOYSA-N,,,PFAS
85651307,HPFOA,[H]C(F)(C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,CLSJUWFCSPJRFC-UHFFFAOYSA-N,,,PFAS
87586550,5:2 fluorotelomer unsaturated acid,OC(=O)\C=C(/F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,VLQRWBZMXZAWNQ-UPHRSURJSA-N,5:2 FTUCA,,PFAS
101399030,7:3 Fluorotelomer unsaturated carboxylic acid,C(=C/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)\C(=O)O,RRROMQAILYJNAL-OWOJBTEDSA-N,7:3 FTUCA,,PFAS
101511824,"[(3,3,4,4,5,5,6,6,6-Nonafluorohexyl)oxy]phosphonic  acid",OP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F,BBLFCNLVILKUEU-UHFFFAOYSA-N,4:2 monoPAP,,PFAS
101523657,beta-keto 7:3 FTCA ,OC(=O)CC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,NVECEEWNYKTCOF-UHFFFAOYSA-N,7:3 beta-keto Acid,,PFAS
101567676,beta-OH 5:3 FTCA ,[H]C(C(O)C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,RAPSXLVXMPNRGD-UHFFFAOYSA-N,,,PFAS
102051058,"1H,1H,2H,2H,8H,8H-perfluoroddodecanoic acid ",[H]\C(C(O)=O)=C(\F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C([H])([H])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,RMYPQKNLXUXTFZ-IWQZZHSRSA-N,"2H,8H,8H-2-PFUDoA",,PFAS
102213916,"0,1-chloroperfluoropolyether carboxylate",OC(=O)C(F)(F)OC(F)(F)C(F)(OC(F)(F)C(F)(Cl)C(F)(F)F)C(F)(F)F,HXIGDGTWZUCBGD-UHFFFAOYSA-N,"(0,1)Cl-PFPECA",,PFAS
112704358,2-acetamidobenzenesulfonyl fluoride ,CC(=O)NC1=C(C=CC=C1)S(F)(=O)=O,HFMREOAQIWKBEK-UHFFFAOYSA-N,,,
122673353,[3-(methoxycarbonylamino)-4-methylphenyl]carbamic acid,[H]N(C(=O)OC)C1=C(C)C=CC(NC(O)=O)=C1,OZCNVRNXLAMPQZ-UHFFFAOYSA-N,,,
132839175,"Hexamethylene-1,6-di(8:2fluorotelomerurethane)",FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)NCCCCCCNC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,ZZPHVBISPDCCKL-UHFFFAOYSA-N,HMU ,,PFAS
139595002,"29-(Perfluorohexyl)-3,6,9,12,15,18,21,24,27-nonaoxanonacosan-1-ol",C(OCCOCCOCCOCCOCCOCCOCCOCCOCCO)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,FXZSYNXDEDCXIS-UHFFFAOYSA-N,6:2 FTEO9,,PFAS
165362406,Hexamethylene-1-(8:2fluorotelomerurethane),OC(=O)NCCCCCCNC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,OCLLMMOKWUGIAX-UHFFFAOYSA-N,,,PFAS
165362410,"2H,8H-2,8-PFUDoA",[H]\C(C(O)=O)=C(\F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(\[H])=C(/F)C(F)(F)C(F)(F)C(F)(F)F,YBHZNIRKOSXPLA-CCAGOZQPSA-N,,,PFAS
165362411,beta-Keto 7:3 FTUCA,OC(=O)CC(=O)C(\F)=C(/F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,LHHAFMRLUSFWCV-SNAWJCMRSA-N,,,PFAS
165362413,"4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-3-oxononanoic acid",OC(=O)CC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,KNPNAEUHRZMNJN-UHFFFAOYSA-N,,,PFAS
165362414,"3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-2-hydroxyoctanal",[H]C(=O)C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,JODCVAUVMXNJNF-UHFFFAOYSA-N,,,PFAS
165362415,"30,30,31,31,32,32,33,33,34,34,35,35,35-tridecafluoro-3,6,9,12,15,18,21,24,27-nonaoxapentatriacontanoic acid",OC(=O)COCCOCCOCCOCCOCCOCCOCCOCCOCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,SOQPUCLZDQHBSF-UHFFFAOYSA-N,,,PFAS
165362416,"{methyl[(1,1,2,2,3,3,4,4,4-nonafluorobutyl)sulfanyl]amino}acetic acid",CN(CC(O)=O)SC(F)(F)C(F)(F)C(F)(F)C(F)(F)F,JSVKCVNWEDSTGS-UHFFFAOYSA-N,,,PFAS
165362417,7:3 FTUUCA,OC(=O)\C=C\C(\F)=C(/F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,DGMVEIYXGVDXMW-NRNIAZNESA-N,,,PFAS
165362581,"Toluene-2,4-di(8:2fluorotelomerurethane) ",[H]N(C(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C1=C(C)C=CC(NC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)=C1,MBMZYCPDXPPEHK-UHFFFAOYSA-N,,,PFAS
165362583,beta-OH 7:3 FTUCA,OC(CC(O)=O)C(\F)=C(/F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,UMEVKGUSPWJNIK-SNAWJCMRSA-N,,,PFAS
165362586,"30,30,31,31,32,32,33,33,34,34,35,35,35-tridecafluoro-3,6,9,12,15,18,21,24,27-nonaoxapentatriacontanal",[H]C(=O)COCCOCCOCCOCCOCCOCCOCCOCCOCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,ASUGEOYGRQXSFC-UHFFFAOYSA-N,,,PFAS
165362589,4:3 FTUCA,[H]\C(=C/C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,OYQPFWFQTWYFRR-OWOJBTEDSA-N,,,PFAS
172915002,"2H,8H-2-oxirane-8-PFUDoA ",OC(=O)\C=C(/F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C1OC1(F)C(F)(F)C(F)(F)C(F)(F)F,IZAYPKWAXSOCAU-UPHRSURJSA-N,,,PFAS
172915003,3-OH 7:3 FTCA,[H]C(O)(CC(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,LGVFKTGNGBMERG-UHFFFAOYSA-N,B-OH 7:3 FTCA,,PFAS
172915004,"(2Z)-3,4,4,5,5,6,6,7,7,9,10,10,11,11,12,12,12-heptadecafluoro-8,9-dihydroxydodec-2-enoic acid",OC(C(O)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(\F)=C\C(O)=O,DZXKOOVETMYKHV-UPHRSURJSA-N,,,PFAS
172915005,7:3 FTCA 2-OH,[H]C(C(O)C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,WGVNPGHMEQBMJX-UHFFFAOYSA-N,,,PFAS
172915006,"difluoro[1,1,2,3,3,3-hexafluoro-2-(1,1,2,3,3,3-hexafluoropropoxy)propoxy]acetic acid",[H]C(F)(C(F)(F)F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)OC(F)(F)C(O)=O,PRHHPWLHMYCAEB-UHFFFAOYSA-N,,,PFAS
5206,Sevoflurane,FCOC(C(F)(F)F)C(F)(F)F,DFEYYRMXOJXZRJ-UHFFFAOYSA-N,,,PFAS
9388,Perfluoroalkyl sulfonyl fluoride,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)S(F)(=O)=O,BHFJBHMTEDLICO-UHFFFAOYSA-N,PFOSF,,PFAS
13529,hexafluoroisopropanol,[H]OC(C(F)(F)F)C(F)(F)F,BYEAHWXPCBROCE-UHFFFAOYSA-N,,,PFAS
67730,"1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluorohexane",FC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,XJSRKJAHJGCPGC-UHFFFAOYSA-N,,,PFAS
67814,Perfluoroalkyl sulfonyl fluoride,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)S(F)(=O)=O,LUYQYZLEHLTPBH-UHFFFAOYSA-N,PFBSF,,PFAS
67918,Perfluoroalkyl sulfonyl fluoride ,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)S(F)(=O)=O,HSDJWNJDPDJOEV-UHFFFAOYSA-N,PFHSF,,PFAS
101652,"1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluorooctane",[H]C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,KBHBUUBXEQUIMV-UHFFFAOYSA-N,,,PFAS
105015,"1,1,3,3,3-pentafluoro-2-(fluoromethoxy)prop-1-ene",FCOC(=C(F)F)C(F)(F)F,VMCHRPIQINOPJR-UHFFFAOYSA-N,,,PFAS
118692,6:2 fluorotelomer sulfonamide alkylbetaine,C[N+](C)(CCCNS(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CC(O)=O,OKOCIUJVPQKDLL-UHFFFAOYSA-O,6:2 FTAB,,PFAS
596595,nonafluorobutane-1-sulfinic acid,OS(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,TWIYDBQRYCWOAU-UHFFFAOYSA-N,,,PFAS
2759273,heptafluoropropan-1-ol,OC(F)(F)C(F)(F)C(F)(F)F,WBXAHKZHOCTGLP-UHFFFAOYSA-N,,,PFAS
2774943,"1,1,2,3,3,3-Hexafluoropropyl methyl ether",COC(F)(F)C(F)(F)C(F)(F)F,NOPJRYAFUXTDLX-UHFFFAOYSA-N,,,PFAS
2776731,"2,3,3,3-Tetrafluoropropene",FC(=C)C(F)(F)F,FXRLMCRCYDHQFW-UHFFFAOYSA-N,,,PFAS
5177764,"3,3,3-trifluoro-2-oxopropanoic acid",OC(=O)C(=O)C(F)(F)F,GVDJEHMDNREMFA-UHFFFAOYSA-N,,,PFAS
10971025,tridecafluorohexane-1-sulfinic acid,OS(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,IYYLVCKNCOIEJX-UHFFFAOYSA-N,,,PFAS
11665471,"1,1,2,3,3,3-Hexafluoropropan-1-ol",OC(F)(F)C(F)C(F)(F)F,GWYGYHQOXMEUPT-UHFFFAOYSA-N,,,PFAS
13528037,"1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylphosphonic acid",OP(O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,CPRNWMZKNOIIML-UHFFFAOYSA-N,,,PFAS
13528039,Diperfluoro-phosphinate,OP(=O)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,BELPOXSOCHBAEX-UHFFFAOYSA-N,C8/C8 PFPiA,,PFAS
14496000,"2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanal",[H]C(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,OLALBODTPKELPY-UHFFFAOYSA-N,,,PFAS
15930820,"1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylphosphonic acid",OP(O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,AGCUFKNHQDVTAD-UHFFFAOYSA-N,,,PFAS
22152050,"4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluoro-3-oxodecanal",[H]C(=O)CC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,RQIOTBIKFNCZMF-UHFFFAOYSA-N,7:3 ?-OH FTUCA,,PFAS
22568738,Perfluoro-2-((6-chlorohexyl)oxy)ethanesulfonic acid,OS(=O)(=O)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Cl,GGOUUEMCWBTDMT-UHFFFAOYSA-N,6:2 Cl-PFESA,,PFAS
54280427,"3,3,3-trifluoro-2-(fluoromethoxy)propanoic acid",[H]C([H])(F)OC(C(O)=O)C(F)(F)F,RQKQLDVHNRCKHL-UHFFFAOYSA-N,,,PFAS
71363384,Diperfluoro-phosphinate(C6/C6 PFPiA),OP(=O)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,NKHVPWOARFMIPG-UHFFFAOYSA-N,C6/C6 PFPiA,,PFAS
71371142,8:2 Fluorotelomer unsaturated aldehyde,FC(=CC=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,LQERGGUGOIACQD-UHFFFAOYSA-N,8:2 FTUAL,,PFAS
85710598,"2-amino-3-{[1,1,3,3,3-pentafluoro-2-(fluoromethoxy)propyl]sulfanyl}propanoic acid",[H]NC(CSC(F)(F)C(OC([H])([H])F)C(F)(F)F)C(O)=O,DLERFRKAVRRKQE-UHFFFAOYSA-N,,,PFAS
85871532,Diperfluoro-phosphinate,OP(=O)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,CQORQFOHIKVJET-UHFFFAOYSA-N,C8/C6 PFPiA,,PFAS
88593725,2-Fluoro-2-(trifluoromethyl)oxirane,FC(F)(F)C1(F)CO1,DHGQMHOMRCABJL-UHFFFAOYSA-N,,,PFAS
91510847,"2-amino-4-{[1-(carboxymethylcarbamoyl)-2-[(3,3,3-trifluoro-2-hydroxypropyl)sulfanyl]ethyl]carbamoyl}butanoic acid",[H]C([H])(SCC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O)C(O)C(F)(F)F,PRQRDVLBLUBQEO-UHFFFAOYSA-N,,,PFAS
102598503,6:2 Fluorotelomer sulfonamido propyl methyl amino acetic acid,CN(CCCNS(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CC(O)=O,DPEDKFNZJCKZOD-UHFFFAOYSA-N,6:2 FTSA-Pr-MeAA ,,PFAS
118327157,"2,3,3,3-tetrafluoropropane-1,2-diol",OCC(O)(F)C(F)(F)F,SUHSDXYIQYZENU-UHFFFAOYSA-N,,,PFAS
139596985,HOPFLSA n=6,[H]C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)S(O)(=O)=O,RVODMNZNWMCSJP-UHFFFAOYSA-N,,,PFAS
165362487,8:2 S-Cys-unsaturated fluorotelomer alcohol ,NC(CS\C(=C/CO)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O,WNBZOPWRFRMUKM-KTAJNNJTSA-N,8:2 uFTOH-SCys,,PFAS
165362492,"(2Z)-3-[(2-amino-2-carboxyethyl)sulfanyl]-4,4,5,5,6,6,7,7,8,8,8-undecafluorooct-2-enoic acid",NC(CS\C(=C/C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O,QMDYXMOEPGMMQX-RJRFIUFISA-N,,,PFAS
165362493,8:2 S-Cys-unsaturated fluorotelomer carboxylic acid ,NC(CS\C(=C/C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O,CZJVLTRNGMEDJV-RJRFIUFISA-N,8:2 FTUCA-SCys,,PFAS
165362494,6:2 S-Cys-unsaturated fluorotelomer alcohol ,NC(CS\C(=C/CO)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O,JTWJADUWMOGXIF-KTAJNNJTSA-N,6:2 uFTOH-SCys,,PFAS
165362498,Glutathione-unsaturated fluorotelomer acid conjugate,NC(CCC(=O)NC(CS\C(=C\C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)NCC(O)=O)C(O)=O,ZOYZDBBMBCZXPK-FPYGCLRLSA-N,,,PFAS
165362499,Glutathione-unsaturated fluorotelomer alcohol conjugate ,NC(CCC(=O)NC(CS\C(=C/CO)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)NCC(O)=O)C(O)=O,SZLFSECIPCQPQO-OQFOIZHKSA-N,6:2 uFTOH-GSH,,PFAS
165362500,S-Cys-Glycine-unsaturated fluorotelomer alcohol conjugate (6:2 uFTOH-SCysGly),NC(CS\C(=C/CO)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)NCC(O)=O,IEBOLNYIUFKLEZ-BHQIHCQQSA-N,6:2 uFTOH-SCysGly,,PFAS
165362501,"S-[(1Z)-1-Carboxy-3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluoro-1-nonen-2-yl]cysteinylglycine",NC(CS\C(=C/C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)NCC(O)=O,OYNVTOCXVNFYCB-KTAJNNJTSA-N,8:2 FTUCA-SCysGly,,PFAS
165362502,"1,1,3,3,3-pentafluoro-2-(fluoromethoxy)propane-1-thiol",[H]C([H])(F)OC(C(F)(F)F)C(F)(F)S,XZOXKYBXXCEUMG-UHFFFAOYSA-N,,,PFAS
165362503,"(1Z)-1,3,3,3-tetrafluoro-2-(fluoromethoxy)prop-1-ene-1-thiol",[H]C([H])(F)O\C(=C(\F)S)C(F)(F)F,OKUWVAYPMFQVQA-IHWYPQMZSA-N,,,PFAS
165362505,6:2 Glutathione-unsaturated fluorotelomer aldehyde conjugate,[H]C(=O)\C=C(/SCC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,MJHWJXHZAJOZKV-OQFOIZHKSA-N,6:2 FTUAL-GSH,,PFAS
165362506,"2-amino-3-{[(1Z)-1,3,3,3-tetrafluoro-2-(fluoromethoxy)prop-1-en-1-yl]sulfanyl}propanoic acid",[H]NC(CS\C(F)=C(/OC([H])([H])F)C(F)(F)F)C(O)=O,KBSCOPZRFNAYCJ-PLNGDYQASA-N,,,PFAS
165362507,Perfluorooctane sulfonamide,NS(=O)(=O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,WXBBNQFZIVWCAJ-UHFFFAOYSA-N,FOSA,,PFAS
165362512,"(2Z)-3-[(2-carboxy-2-acetamidoethyl)sulfanyl]-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluorodec-2-enoic acid",CC(=O)NC(CS\C(=C/C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O,FNIJOVPNZJKRGN-KXFIGUGUSA-N,,,PFAS
165362515,"2-acetamido-3-{[(2Z)-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluoro-1-hydroxydec-2-en-3-yl]sulfanyl}propanoic acid",CC(=O)NC(CS\C(=C/CO)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O,DKDVVAGXPDRXSP-UQCOIBPSSA-N,,,PFAS
165362517,"2-acetamido-3-{[(2Z)-4,4,5,5,6,6,7,7,8,8,8-undecafluoro-1-hydroxyoct-2-en-3-yl]sulfanyl}propanoic acid",CC(=O)NC(CS\C(=C/CO)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(O)=O,WBUHSFJYUTVBGG-UQCOIBPSSA-N,,,PFAS
165362518,"6-[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid",OC1C(O)C(OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)OC(C1O)C(O)=O,RYSOJIPWMVREAU-UHFFFAOYSA-N,,,PFAS
165362519,"3,4,5-trihydroxy-6-[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluorononan-2-yl)oxy]oxane-2-carboxylic acid",[H]OC1C(O)C(OC(OC(C)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C1O[H])C(O)=O,HBCRAAGGUPYIKR-UHFFFAOYSA-N,,,PFAS
165362534,"2-amino-4-{[1-(carboxymethylcarbamoyl)-2-{[(1Z)-1,3,3,3-tetrafluoro-2-(fluoromethoxy)prop-1-en-1-yl]sulfanyl}ethyl]carbamoyl}butanoic acid",NC(CCC(=O)NC(CS\C(F)=C(/OCF)C(F)(F)F)C(=O)NCC(O)=O)C(O)=O,SNBAUZARSWJEFQ-KHPPLWFESA-N,,,PFAS
165362536,"(2E)-3-{[2-amino-2-(carboxymethylcarbamoyl)ethyl]sulfanyl}-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluorodec-2-enoic acid",NC(CS\C(=C\C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)NCC(O)=O,OYNVTOCXVNFYCB-ORCRQEGFSA-N,,,PFAS
165362539,"2-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluorodecanamido)ethanesulfonic acid",OS(=O)(=O)CCNC(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,OYMHNAGKAKNMTM-UHFFFAOYSA-N,,,PFAS
165362540,"4,4,5,5,6,6,7,7,8,8,8-undecafluoro-1-hydroxyoctan-2-one",OCC(=O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,TUIZCBLTSMVZHV-UHFFFAOYSA-N,,,PFAS
165362544,"3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluoro-2-hydroxydecanoic acid",OC(C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,PTSJFWHEUPNFFL-UHFFFAOYSA-N,,,PFAS
165362545,"(2Z)-3-{[2-amino-2-(carboxymethylcarbamoyl)ethyl]sulfanyl}-4,4,5,5,6,6,7,7,8,8,8-undecafluorooct-2-enoic acid",NC(CS\C(=C/C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(=O)NCC(O)=O,MZEPUAVAPVRERS-KTAJNNJTSA-N,6:2 FTUCA-SCysGly,,PFAS
165362590,"2-amino-4-{[1-(carboxymethylcarbamoyl)-2-[(3,3,3-trifluoro-2-oxopropyl)sulfanyl]ethyl]carbamoyl}butanoic acid",NC(CCC(=O)NC(CSCC(=O)C(F)(F)F)C(=O)NCC(O)=O)C(O)=O,RPJBLOQRVGLINC-UHFFFAOYSA-N,,,PFAS
165362591,7-3 beta-Hydroxy unsaturated acid ,OC(=O)\C=C(/O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,ZZTLVWGFGISKOP-UPHRSURJSA-N,7:3 beta-OH UA,,PFAS
165362592,7:3 Fluorotelomer unsaturated aldehyde ,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)\C=C\C=O,KMPQUCAHSGTSIB-OWOJBTEDSA-N,7:3 FTUAL,,PFAS
165362593,"2-amino-4-{[1-(carboxymethylcarbamoyl)-2-{[(2Z)-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-pentadecafluoro-1-hydroxydec-2-en-3-yl]sulfanyl}ethyl]carbamoyl}butanoic acid",[H]C(O)\C=C(/SCC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F,GDHKCTTYXGATBF-OQFOIZHKSA-N,,,PFAS
165362594,7:3 Fluorotelomer aldehyde ,FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCC=O,UYOBYWFWAOPJHI-UHFFFAOYSA-N,7:3 FTAL,,PFAS
7103,4-Phenylphenol,C1=CC=C(C=C1)C2=CC=C(C=C2)O,YXVFYQXJAXKLAK-UHFFFAOYSA-N,4-Hydroxybiphenyl,,Biphenyl
7112,"4,4'-Dihydroxybiphenyl",C1=CC(=CC=C1C2=CC=C(C=C2)O)O,VCCBEIPGXKNHFW-UHFFFAOYSA-N,"4,4'-Dihydroxybiphenyl",,Biphenyl
7245,2-Chlorophenol ,c1(ccccc1Cl)O,ISPYQTSUDJAMAB-UHFFFAOYSA-N,2-Chlorophenol ,,
13878,Deisopropylatrazine,CCNC1=NC(=NC(=N1)N)Cl,IVENSCMCQBJAKW-UHFFFAOYSA-N,Deisopropylatrazine,,Triazine
15466,AMMT,Cc1nc(nc(n1)OC)N,NXFQWRWXEYTOTK-UHFFFAOYSA-N,"2-Amino-4-methoxy-6-methyl-1,3,5-triazine",,Triazine
16443,Chlorsulfuron-triazinone,Cc1nc(nc(n1)O)O,KZVYWMJOLANZSI-UHFFFAOYSA-N,"6-Methyl-1,3,5-triazine-2,4(1H,3H)-dione",,Triazine
21497,Desethyl-Deisopropylametryne,Nc1nc(nc(n1)SC)N,SFPNVVXUUHYBQW-UHFFFAOYSA-N,"6-(Methylthio)-1,3,5-triazine-2,4-diamine",,Triazine
22563,Deethylatrazine,CC(C)NC1=NC(=NC(=N1)N)Cl,DFWFIQKMSFGDCQ-UHFFFAOYSA-N,Deethylatrazine,,Triazine
25902,1-Methylbenzotriazole,CN1C2=CC=CC=C2N=N1,HXQHRUJXQJEGER-UHFFFAOYSA-N,1-Methylbenzotriazole,,Triazole
35229,"Desmethylthio-desethylsimetryn, DMT-DES",CCNC1=NC=NC(=N1)N,ZCMOXKOUKFOYFB-UHFFFAOYSA-N,Dechloro-disopropyl atrazine (DDIA),,Triazine
39385,Triadimefon,CC(C)(C)C(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)Cl,WURBVZBTWMNKQT-UHFFFAOYSA-N,Triadimefon,,Triazine
52999,Metsulfuron-methyl,CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC,RSMUVYRMZCOLBH-UHFFFAOYSA-N,Metsulfuron-methyl,,Triazine
72917,1H-benzotriazole-5-carboxylic acid,C1=CC2=NNN=C2C=C1C(=O)O,GUOVBFFLXKJFEE-UHFFFAOYSA-N,2H-benzotriazole-5-carboxylic acid,,Benzotriazole
81410,2-Chlorobenzenesulfonamide,NS(=O)(=O)c1ccccc1Cl,JCCBZCMSYUSCFM-UHFFFAOYSA-N,2-Chlorobenzenesulfonamide,,Sulfonamide
100877,"3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one",CC(C)(C)C(=O)CN1C=NC=N1,FMWWRALTYIWZEB-UHFFFAOYSA-N,"3,3-Dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one",,Triazole
151248,(2-chlorophenyl)sulfonylurea,NC(=O)NS(=O)(=O)c1ccccc1Cl,KQRMGBSYWRUESQ-UHFFFAOYSA-N,N-(Aminocarbonyl)-2-chlorobenzenesulfonamide,,Sulfonamide
157728,Chlorsulfuron-5-hydroxy or 5-hydroxy-chlorsulfuron,Cc1nc(nc(n1)OC)NC(=O)NS(=O)(=O)c2cc(ccc2Cl)O,IVNIYQSXICOYPT-UHFFFAOYSA-N,"1-(2-chloro-3-hydroxybenzenesulfonyl)-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea",,Triazine
186839,Dechloro-Deethylatrazine,CC(C)Nc1ncnc(n1)N,WBEKRMVYCWRRDJ-UHFFFAOYSA-N,"2-Amino-6-(isopropylamino)1,3,5-triazine",,Triazine
603744,"Desethyl-simetryn, Deisopropylametryne",CCNc1nc(nc(n1)SC)N,CMKCJDAIKRRBDY-UHFFFAOYSA-N,Deisopropylametryne,,Triazine
608030,Deethylametryne,CC(C)NC1=NC(=NC(=N1)N)SC,PWERJYSEXWGFLB-UHFFFAOYSA-N,"6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine",,Triazine
703104,propiconazole TP2,C1=CC(=C(C=C1Cl)Cl)[C@@H](CN2C=NC=N2)O,XCWJBJOPHSVLGU-SNVBAGLBSA-N,"(1S)-1-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)ethanol",,Triazole
1233632,S-Desmethyl Ametryn,CCNc1nc(nc(n1)S)NC(C)C,BAAMDWUVIPLPOL-UHFFFAOYSA-N,"4-(Ethylamino)-6-(isopropylamino)-1,3,5-triazine-2-thiol",,Triazine
1810180,Triazole acetic acid,C1=NN(C=N1)CC(=O)O,RXDBSQXFIWBJSR-UHFFFAOYSA-N,"1,2,4-Triazole-1-acetic acid",,Triazole
3032374,S-demethyl-simetryn,S=C1N=C(NCC)N=C(NCC)N1,FNFHKYYENMTFNM-UHFFFAOYSA-N,"2,6-bis(ethylamino)-1H-1,3,5-triazine-4-thione",,Triazine
6412338,"1H-1,2,3-benzotriazol-5-ylmethanol",C1=CC2=NNN=C2C=C1CO,UWJOSAIHEQFOID-UHFFFAOYSA-N,"1H-1,2,3-benzotriazol-5-ylmethanol",,Benzotriazole
6451955,Bitertanol-Ketone,CC(C)(C)C(C(n1cncn1)Oc2ccc(cc2)-c3ccccc3)=O,UKZCPXGKCGMLBY-UHFFFAOYSA-N,"3,3-dimethyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)but-1-en-2-ol",,Triazole
6454490,1H-benzotriazole-4-carboxylic acid,C1=CC2=NNN=C2C(=C1)C(=O)O,KFJDQPJLANOOOB-UHFFFAOYSA-N,2H-benzotriazole-4-carboxylic acid,,Benzotriazole
11469186,"N,N-Dimethylmelamine",Nc1nc(nc(n1)NC)NC,CHOSFPFCXKKOHO-UHFFFAOYSA-N,"N,N-Dimethylmelamine",,Triazine
13531453,2-Chlorobenzenesulfonic acid,C1=CC=C(C(=C1)S(=O)(=O)O)Cl,MNURPFVONZPVLA-UHFFFAOYSA-N,2-Chlorobenzenesulfonic acid,,
13568505,"methyl 3-(1H-1,2,4-triazol-1-yl)propanoate",c1nn(cn1)CCC(=O)OC,PVTDBXDIDCTVFV-UHFFFAOYSA-N,"methyl 3-(1H-1,2,4-triazol-1-yl)propanoate",,Triazole
14835678,"2,5-dimethylbenzotriazole",CC1=CC2=NN(N=C2C=C1)C,XFMKHBNWJKZGDB-UHFFFAOYSA-N,"2,5-dimethylbenzotriazole",,Benzotriazole
15818023,(Hydroxy-isopropyl)-atrazine,CCNC1=NC(=NC(=N1)Cl)NC(C)CO,PQOIZBRRWJWKAC-UHFFFAOYSA-N,"2-Chloro-4-(ethylamino)-6-(1-methyl-2-hydroxyethylamino)-1,3,5-triazine",,Triazine
17805169,Dechlorophenyl-defenoconazole,CC1COC(O1)(Cn2cncn2)c3c(cc(cc3)O)Cl,JCRXVKPWUDJRCR-UHFFFAOYSA-N,"3-chloro-4-[4-methyl-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-2-yl]phenol ",,Triazole
18434540,Methyl 3-chloro-2-sulfamoylbenzoate,COC(=O)C1=C(C(=CC=C1)Cl)S(=O)(=O)N,RLUYMCWGOHRIRZ-UHFFFAOYSA-N,Methyl 3-chloro-2-sulfamoylbenzoate,,
20070433,Difenoconazole-alcohol,C1=CC(=CC=C1OC2=CC(=C(C=C2)C(CN3C=NC=N3)O)Cl)Cl,NBYSKMWDHCZSIP-UHFFFAOYSA-N,"1-[2-chloro-4-(4-chlorophenoxy)phenyl]-2-(1,2,4-triazol-1-yl)ethanol",,Triazole
20225484,N-(2-chlorophenyl)sulfonylcarbamate,C(=O)(NS(=O)(=O)c1ccccc1Cl)O,FULSIHOOFUQXTB-UHFFFAOYSA-N,N-(2-chlorophenyl)sulfonylcarbamate,,
80779841,Deethylatrazine-alcohol,CC(CO)NC1=NC(=NC(=N1)N)Cl,FNBALTXVJTUUKU-UHFFFAOYSA-N,"2-[(4-Amino-6-chloro-1,3,5-triazin-2-yl)amino]propan-1-ol",,Triazine
91726861,"PFPrA-N-Glycine conjugate, PFPrA-glycine conjugate",C(=O)(C(C(F)(F)F)(F)F)NCC(OC)=O,VQVKUEWRCJYNCA-UHFFFAOYSA-N,"methyl 2-(2,2,3,3,3-pentafluoropropanoylamino)acetate ",,PFAS
102332589,HWG 1608-lactone (M17),CC(C)(C)C1(CCC(=O)O1)CN2C=NC=N2,DVLMVKDOFMLUEE-UHFFFAOYSA-N,"5-tert-butyl-5-(1,2,4-triazol-1-ylmethyl)oxolan-2-one",,Triazole
122691685,Ammelide-ketone,NC1=NC(=O)NC(O)N1,MTVGISLWTIDTOW-UHFFFAOYSA-N,"4-amino-6-hydroxy-1,2,5,6-tetrahydro-1,3,5-triazin-2-one",,Triazine
135398733,2-Hydroxyatrazine,CCNC1=NC(=O)NC(=N1)NC(C)C,NFMIMWNQWAWNDW-UHFFFAOYSA-N,2-Hydroxyatrazine,,Triazine
135398734,"Deisopropylhydroxyatrazine, Desethyl-hydroxy-simetryn, Desethylhydroxysimazine",CCNc1nc(nc(n1)O)N,XRVCXZWINJOORX-UHFFFAOYSA-N,"6-amino-4-(ethylamino)-1H-1,3,5-triazin-2-one",,Triazine
135399234,Acetoguanide,Cc1nc(nc(n1)O)N,UUTHDVPZNWJUFV-UHFFFAOYSA-N,"4-Amino-6-methyl-1,3,5-triazin-2-ol",,Triazine
135408659,"Hydroxysimazine, Hydroxy-simetryn",Oc1nc(NCC)nc(NCC)n1,YQIXRXMOJFQVBV-UHFFFAOYSA-N,"4,6-bis(ethylamino)-1H-1,3,5-triazin-2-one",,Triazine
135408770,Ammeline-tautomer,Nc1nc(nc(n1)N)O,MASBWURJQFFLOO-UHFFFAOYSA-N,"4,6-diamino-1,3,5-triazin-2-ol",,Triazine
135438601,Chloro-ammeline,C1(=NC(=O)NC(=N1)Cl)N,GHCVXTFBVDVFGE-UHFFFAOYSA-N,"4-Amino-6-chloro-1,3,5-triazin-2-ol",,Triazine
135510207,Atrazine-desethyl-2-hydroxy,CC(C)NC1=NC(=O)NC(=N1)N,GCKLGRUZDXSATG-UHFFFAOYSA-N,"6-amino-4-(propan-2-ylamino)-1H-1,3,5-triazin-2-one",,Triazine
135591014,7-methyl-2H-benzotriazol-4-ol ,Cc1ccc(c2n[nH]nc12)O,RAMPCEHLXVIXEQ-UHFFFAOYSA-N,7-methyl-2H-benzotriazol-4-ol,,Benzotriazole
136421217,6-methyl-2H-benzotriazol-4-ol,Cc1cc2n[nH]nc2c(c1)O,JHLDJGBMZOZALO-UHFFFAOYSA-N,6-methyl-2H-benzotriazol-4-ol,,Benzotriazole
139595450,HWG 1608-4-hydroxy (M05),CC(C)(C)C(CN1C=NC=N1)(C(CC2=CC=C(C=C2)Cl)O)O,IRDRELWMVRYDCP-UHFFFAOYSA-N,"1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentane-2,3-diol",,Triazole
139597290,Pyroxsulam N-cyan­sulfonamide,COC1=NC=CC(=C1S(=O)(=O)NC#N)C(F)(F)F,UHQMUHGVGXBPEM-UHFFFAOYSA-N,N-cyano-2-methoxy-4-(trifluoromethyl)pyridine-3-sulfonamide,,PFAS
139597633,7-OH-Xde-742; pyroxsulam TP2,COC1=CC(=O)N2C(=N1)N=C(N2)NS(=O)(=O)C3=C(C=CN=C3OC)C(F)(F)F,DTJDXDQUWHWQHV-UHFFFAOYSA-N,"2-methoxy-N-(7-methoxy-5-oxo-4H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-(trifluoromethyl)pyridine-3-sulfonamide",,PFAS
139788702,7-methyl-2H-benzotriazol-5-ol,Cc1cc(cc2n[nH]nc12)O,VKBLQLFCBLTVFU-UHFFFAOYSA-N,7-methyl-2H-benzotriazol-5-ol,,Benzotriazole
169447403,Bisphenol AF glucuronide,C1=CC(=CC=C1C(C2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)(C(F)(F)F)C(F)(F)F)O,UFFJVOVWHMUYPR-RNGZQALNSA-N,"(2S,3S,4S,5R)-6-{4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid",,PFAS
169451322,O-desmethyl-chlorsulfuron,Cc1nc(nc(n1)O)NC(=O)NS(=O)(=O)c2ccccc2Cl,FCCMQXNSYOONSJ-UHFFFAOYSA-N,"1-(2-chlorophenyl)sulfonyl-3-(2-methyl-6-oxo-1H-1,3,5-triazin-4-yl)urea",,Triazine
NA,2-hydroxy-metconazole,CC1(CCC(C1(Cn2cncn2)O)Cc3ccc(cc3O)Cl)C,XAQNKKPKTJAWBT-UHFFFAOYSA-N,"5-chloro-2-({2-hydroxy-3,3-dimethyl-2-[(1H-1,2,4-triazol-1-yl)methyl]cyclopentyl}methyl)phenol",,Triazole
NA,Hydroxyethyl-simetryn,CCNC1=NC(=NC(=N1)SC)NCCO,RHXYUTIBZXEVIZ-UHFFFAOYSA-N,"2-{[4-(ethylamino)-6-(methylsulfanyl)-1,3,5-triazin-2-yl]amino}ethan-1-ol",,Triazine
NA,Paclobutrazol-hydroxy-glucuronide,CC(C)(C)C(C(CC1=CC=C(C(C1)=O)Cl)n2c[n+](cn2)C3C(C(O)C(C(O3)C(O)=O)O)O)O,BXYBTTSZUJCYLM-UHFFFAOYSA-O,Paclobutrazol-hydroxy-glucuronide,,Triazole
NA,Atrazine-GSH-conjugate,CCNc1nc(nc(n1)SCCC(=O)NCC(O)=O)NC(C)C,GOJNKIKCITVQDE-UHFFFAOYSA-N,"[3-({4-(ethylamino)-6-[(propan-2-yl)amino]-1,3,5-triazin-2-yl}sulfanyl)propanamido]acetic acid",,Triazine
NA,Benzotriazole glucuronide–glycine conjugation,c1cc2nn(nc2cc1)C3OC(C(=O)NCC(O)=O)C(O)C(O)C3O,ODDTXCUGSDRZLT-UHFFFAOYSA-N,"[6-(2H-1,2,3-benzotriazol-2-yl)-3,4,5-trihydroxyoxane-2-carboxamido]acetic acid",,Benzotriazole
NA,Bitertanol-TP1,CC(C)(CO)C(C(n1cncn1)=O)=O,PXEHVRBEXITJQB-UHFFFAOYSA-N,"4-hydroxy-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butane-1,2-dione",,Triazole
NA,Dechlorohydroxy-paclobutrazol,CC(C)(C)C(C(CC1CCC(C=C1)=O)n2cncn2)O,DMKVSYWGNDPMDH-UHFFFAOYSA-N,"4-[3-hydroxy-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentyl]cyclohex-3-en-1-one",,Triazole
NA,3-hydroxydifenoconazole,CC1COC(CN2C=NC=N2)(O1)C1=CC=C(OC2=CC=C(Cl)C=C2O)C=C1Cl,ODYMAPXXFNVTBU-UHFFFAOYSA-N,"5-chloro-2-(3-chloro-4-{4-methyl-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolan-2-yl}phenoxy)phenol",,Triazole
NA,2-hydroxydifenoconazole,CC1COC(CN2C=NC=N2)(O1)C1=CC=C(OC2=CC=C(Cl)C(O)=C2)C=C1Cl,HAARDVIJTGQNKV-UHFFFAOYSA-N,"2-chloro-5-(3-chloro-4-{4-methyl-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolan-2-yl}phenoxy)phenol",,Triazole
NA,Simetryn-sulfone,CS(=O)(=O)C1=NC(N)=NC(N)=N1,OKMJVRZHXQVGSN-UHFFFAOYSA-N,"6-methanesulfonyl-1,3,5-triazine-2,4-diamine",,Triazine
NA,Simetryn-sulfonium,CCNC1=NC(=NC(=N1)[S+](C)C)NCC,NMBCYHFVAVLZIW-UHFFFAOYSA-N,"[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]dimethylsulfanium",,Triazine
NA,Simetryn-sulfanuide,CCNc1nc(nc(n1)S=O)NCC,HKMMIXDPCROLHC-UHFFFAOYSA-N,"[4,6-bis(ethylamino)-1,3,5-triazin-2-yl](oxo)sulfanuide",,Triazine
NA,4-hydroxy-dechloro-metconazole,CC1(CCC(C1(Cn2cncn2)O)Cc3ccc(cc3)O)C,WSFFLPYEIYHPEY-UHFFFAOYSA-N,"4-({2-hydroxy-3,3-dimethyl-2-[(1H-1,2,4-triazol-1-yl)methyl]cyclopentyl}methyl)phenol",,Triazole
NA,O-methylcarboxy-chlorsulfuron,COC(=O)C1=CC=CC(Cl)=C1S(=O)(=O)NC(=O)NC1=NC(C)=NC(OC)=N1,FMZDEBLFQPQXKF-UHFFFAOYSA-N,"methyl 3-chloro-2-({[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]amino}sulfonyl)benzoate",,Triazine
NA,Carboxyethyl-simetryn,CCNC1=NC(NCC(O)=O)=NC(SC)=N1,KAVCBDNFHDTNIZ-UHFFFAOYSA-N,"2-{[4-(ethylamino)-6-(methylsulfanyl)-1,3,5-triazin-2-yl]amino}acetic acid",,Triazine
NA,Dehydrocarboxyethyl-simetryn,CCNC1=NC(SC)N=C(NCC(O)=O)N1,BHQFSOKCRLLTDU-UHFFFAOYSA-N,"2-{[6-(ethylamino)-4-(methylsulfanyl)-1,4-dihydro-1,3,5-triazin-2-yl]amino}acetic acid",,Triazine
NA,Simetryn-glucoronide,CCNC1=NC(SC2C(C(O)=O)C(=O)C(O)OC2=O)N=C(NCC)N1,CXDGBFDUMWQPFX-UHFFFAOYSA-N,"3-{[4,6-bis(ethylamino)-2,5-dihydro-1,3,5-triazin-2-yl]sulfanyl}-6-hydroxy-2,5-dioxooxane-4-carboxylic acid",,Triazine
NA,Dehydrohydroxyethyl-simetryn,CCNC1=NC(SC)N=C(NCCO)N1,CPRGZMYHNXPRDA-UHFFFAOYSA-N,"2-{[6-(ethylamino)-4-(methylsulfanyl)-1,4-dihydro-1,3,5-triazin-2-yl]amino}ethan-1-ol",,Triazine
NA,"2,4-diphenyl-2-[(1H-1,2,4-triazol-1-yl)methyl]butanoic acid",c1ccc(cc1)C(CCc2ccccc2)(Cn3cncn3)C(O)=O,LRFBZJOMEMEOLU-UHFFFAOYSA-N,"2,4-diphenyl-2-[(1H-1,2,4-triazol-1-yl)methyl]butanoic acid",,Triazole
NA,4-Methoxybiphenyl,CC(C)(C)C(C(n1cncn1)=O)O,LTBIUCDCSLBASR-UHFFFAOYSA-N,4-Methoxybiphenyl,,Biphenyl
NA,Difenoconazole sulfate conjugate,C(C1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl)OS(O)(=O)=O,MNPXONFXPVMPGN-UHFFFAOYSA-N,Difenoconazole sulfate conjugate,,Triazole
NA,"1,2,4 triazole-glucuronide",[nH]1c[n+](cn1)C2C(C(O)C(C(O2)C(O)=O)O)O,XRXUUQNIUJZJPS-UHFFFAOYSA-O,"4-(6-carboxy-3,4,5-trihydroxyoxan-2-yl)-1H-1,2,4-triazol-4-ium",,Triazole
NA,1-hydroxyethylametryn,C(CNC1=NC(=NC(=N1)SC)NC(C)C)O,VXNQHTZTGRUCAU-UHFFFAOYSA-N,"2-({4-(methylsulfanyl)-6-[(propan-2-yl)amino]-1,3,5-triazin-2-yl}amino)ethan-1-ol",,Triazine
NA,2-dechloro-desdioxolane difenoconazole,C(Cn1cncn1)c2c(cc(cc2)Oc3ccccc3)Cl,WBZYVDBSFXDGGJ-UHFFFAOYSA-N,"1-{2-[4-(4-chlorophenoxy)phenyl]ethyl}-1H-1,2,4-triazole",,Triazole
NA,Bitertanol-TP2,CC(C)(C)C(C(Oc1ccc(cc1)-c2ccccc2)=O)O,OTOJAUCQGFQSDI-UHFFFAOYSA-N,"[1,1'-biphenyl]-4-yl 2-hydroxy-3,3-dimethylbutanoate",,Biphenyl
NA,Deethylatrazine-aldehyde,CC(C=O)Nc1nc(nc(n1)N)Cl,ZPXGPJRCFOOFGG-UHFFFAOYSA-N,"2-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]propanal",,Triazine
NA,Difenoconazole-TP2,CC1COC(CN2C=NC=N2)(O1)C1=CC=C(OC2=CC=C(Cl)C=C2)C=C1,RVYMADFKKYNZFU-UHFFFAOYSA-N,"1-({2-[4-(4-chlorophenoxy)phenyl]-4-methyl-1,3-dioxolan-2-yl}methyl)-1H-1,2,4-triazole",,Triazole
NA,Hydroxy-methyl-Cyromazine,C1CC1NC2=NC(=NC(=N2)N)NCO,ZUXDLRKSIHOLBL-UHFFFAOYSA-N,"{[4-amino-6-(cyclopropylamino)-1,3,5-triazin-2-yl]amino}methanol",,Triazine
NA,TFA-Taurine conjugate,C(=O)(C(F)(F)F)N(CCS(O)(=O)=O)O,DQTYLJANFFFEIA-UHFFFAOYSA-N,"2-(2,2,2-trifluoro-N-hydroxyacetamido)ethane-1-sulfonic acid",,PFAS