ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001043
RECORD_TITLE: 2-PHENYLBUTANEDIOIC ACID BIS(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$NAME: 2-PHENYLBUTANEDIOIC ACID BIS(TRIMETHYLSILYL) ESTER
CH$NAME: DI(TRIMETHYLSILYL) 2-PHENYLSUCCINATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₂₆O₄Si₂
CH$EXACT_MASS: 338.13696
CH$SMILES: O=C(O[Si](C)(C)C)CC(c(c1)cccc1)C(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C16H26O4Si2/c1-21(2,3)19-15(17)12-14(13-10-8-7-9-11-13)16(18)20-22(4,5)6/h7-11,14H,12H2,1-6H3
CH$LINK: INCHIKEY QSFAPKMHJXZWEF-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$SPLASH: splash10-006t-6920000000-5fa54c78afcd52c3ed1f
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  45 12.3 123
  73 97.4 974
  75 26.4 264
  77 2.3 23
  103 11.1 111
  104 31.6 316
  131 11.9 119
  132 1.15 12
  147 99.99 999
  148 15.3 153
  190 15.3 153
  205 0.89 9
  248 11.5 115
  294 27.3 273
  295 8.1 81
  323 8.9 89
//