ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009923
RECORD_TITLE: 4-(4-ACETOXYPHENOXY)BENZOIC ACID; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 4-(4-ACETOXYPHENOXY)BENZOIC ACID
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H12O5
CH$EXACT_MASS: 272.06847
CH$SMILES: CC(=O)Oc(c2)ccc(c2)Oc(c1)ccc(C(O)=O)c1
CH$IUPAC: InChI=1S/C15H12O5/c1-10(16)19-12-6-8-14(9-7-12)20-13-4-2-11(3-5-13)15(17)18/h2-9H,1H3,(H,17,18)
CH$LINK: INCHIKEY BALYRASTARBISG-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-001i-1090000000-6429287dfc1b01cea177
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  28 3 30
  39 1.4 14
  42 0.9 9
  43 0.53 5
  44 0.3 3
  50 1.3 13
  51 1.3 13
  53 0.05 1
  54 0.2 2
  63 1.3 13
  64 0.6 6
  65 0.52 5
  75 1.1 11
  76 1.7 17
  81 1.6 16
  92 0.12 1
  93 0.6 6
  104 1.1 11
  105 1.3 13
  109 0.47 5
  121 0.8 8
  127 1.1 11
  128 1.9 19
  129 0.16 2
  139 0.2 2
  156 0.2 2
  157 2.8 28
  158 0.02 0
  184 1.6 16
  185 1.6 16
  213 6.1 61
  230 99.99 999
  231 14.1 141
  232 1.1 11
  255 0.2 2
  272 4.2 42
//
