ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007491
RECORD_TITLE: 3-NITROPHENYLACETIC ACID TRIMETHYLSILYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA
CH$NAME: 3-NITROPHENYLACETIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H15NO4Si
CH$EXACT_MASS: 253.07703
CH$SMILES: [O-1][N+1](=O)c(c1)cc(cc1)CC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C11H15NO4Si/c1-17(2,3)16-11(13)8-9-5-4-6-10(7-9)12(14)15/h4-7H,8H2,1-3H3
CH$LINK: INCHIKEY XTPSTALVFAMKRF-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-01-SG
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: splash10-00di-9020000000-5b8deeaf07449833549c
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  43 1.7 17
  44 3.4 34
  45 6.9 69
  47 0.48 5
  51 1.7 17
  58 0.6 6
  59 0.6 6
  61 0.31 3
  62 0.6 6
  63 3.8 38
  64 1 10
  73 99.99 999
  74 11.4 114
  75 51.2 512
  76 4.8 48
  77 0.38 4
  78 1.3 13
  82 4.1 41
  89 8.3 83
  90 0.79 8
  91 0.6 6
  96 0.6 6
  117 2.4 24
  136 0.1 1
  141 1.3 13
  209 22.1 221
  210 2.7 27
  211 0.1 1
  238 20.4 204
  239 3.1 31
  240 0.6 6
//
