ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003569
RECORD_TITLE: 2-(2-HYDROXY-3,5-DI-TERT-BUTYL)PHENYL-5-CHLOROBENZOTRIAZOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 2-(2-HYDROXY-3,5-DI-TERT-BUTYL)PHENYL-5-CHLOROBENZOTRIAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C20H24ClN3O
CH$EXACT_MASS: 357.16079
CH$SMILES: Clc(c3)cc(n1)c(c3)nn1c(c2)c(O)c(cc(C(C)(C)C)2)C(C)(C)C
CH$IUPAC: InChI=1S/C20H24ClN3O/c1-19(2,3)12-9-14(20(4,5)6)18(25)17(10-12)24-22-15-8-7-13(21)11-16(15)23-24/h7-11,25H,1-6H3
CH$LINK: INCHIKEY UWSMKYBKUPAEJQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4038893
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-3109000000-ab487716d3529c6d4a80
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  29 10.34 103
  41 16.64 166
  43 2.58 26
  55 2.55 26
  57 32.4 324
  77 3.83 38
  91 5.51 55
  103 2.55 26
  105 6.88 69
  115 2.27 23
  126 4.92 49
  128 3.1 31
  131 3.12 31
  133 2.98 30
  135 4.42 44
  149 5.36 54
  150 2.44 24
  163 5.25 53
  164 2.75 28
  286 3.84 38
  328 6.79 68
  342 99.99 999
  343 20.86 209
  344 31.24 312
  345 6.85 69
  357 33.64 336
  358 7.71 77
  359 11.63 116
  360 2.32 23
//
