ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000611
RECORD_TITLE: 2-(TRIMETHYLSILYL)OXY-EICOSANOIC 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$NAME: 2-(TRIMETHYLSILYL)OXY-EICOSANOIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₆H₅₆O₃Si₂
CH$EXACT_MASS: 472.37680
CH$SMILES: C(CCCCCCCCCCCCCCCCCC)(O[Si](C)(C)C)C(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C26H56O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(28-30(2,3)4)26(27)29-31(5,6)7/h25H,8-24H2,1-7H3
CH$LINK: INCHIKEY UVWFZVLVNGBIJE-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:101618138

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$SPLASH: splash10-0ab9-9304000000-1269595d14b0d3057219
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  43 11.2 112
  57 25.1 251
  69 14.2 142
  71 1.29 13
  73 99.99 999
  75 19.9 199
  83 19.4 194
  97 1.86 19
  99 10.8 108
  103 15.1 151
  111 10.3 103
  117 1.6 16
  129 14.7 147
  147 38 380
  148 10.8 108
  221 1.25 13
  355 90 900
  356 12.9 129
  430 13.4 134
  457 5.1 51
//