ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007493
RECORD_TITLE: 4-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$NAME: 4-NITROPHENYLACETIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₅NO₄Si
CH$EXACT_MASS: 253.07703
CH$SMILES: [O-1][N+1](=O)c(c1)ccc(c1)CC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C11H15NO4Si/c1-17(2,3)16-11(13)8-9-4-6-10(7-5-9)12(14)15/h4-7H,8H2,1-3H3
CH$LINK: INCHIKEY PWLZPIFYJDAYBA-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$SPLASH: splash10-00di-9010000000-42af64c4c816b4a25594
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  43 2.5 25
  44 2.8 28
  45 7.1 71
  47 0.35 4
  57 2.5 25
  59 1 10
  61 2.5 25
  63 0.43 4
  73 99.99 999
  74 10.4 104
  75 50.7 507
  76 0.46 5
  77 1.4 14
  78 2.8 28
  82 3.2 32
  89 0.79 8
  90 7.1 71
  106 1.7 17
  117 4.6 46
  179 0.14 1
  194 3.9 39
  209 21.2 212
  210 2.8 28
  238 2.08 21
  239 3.5 35
//