ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001905
RECORD_TITLE: ALPHA-ETHYL-ALPHA-PHENYLACETIC 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$NAME: ALPHA-ETHYL-ALPHA-PHENYLACETIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₂₀O₂Si
CH$EXACT_MASS: 236.12326
CH$SMILES: CCC(c(c1)cccc1)C(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C13H20O2Si/c1-5-12(11-9-7-6-8-10-11)13(14)15-16(2,3)4/h6-10,12H,5H2,1-4H3
CH$LINK: INCHIKEY VYKUZPWIVBWKQA-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$SPLASH: splash10-00vl-9500000000-e420e57c1e37a418a5da
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  43 4.3 43
  44 4.3 43
  45 25 250
  47 1.25 13
  51 5 50
  61 4.3 43
  73 91.8 918
  74 3.68 37
  75 87.5 875
  76 5 50
  77 36.2 362
  78 0.43 4
  89 4.3 43
  90 5 50
  91 38.7 387
  115 0.5 5
  117 23.1 231
  118 99.99 999
  119 7.5 75
  147 0.31 3
  148 5 50
  192 39.3 393
  193 5 50
  221 3.56 36
  222 4.3 43
//