ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001109
RECORD_TITLE: 8-METHYLNONANOIC 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$NAME: 8-METHYLNONANOIC ACID TRIMETHYLSILYL ESTER
CH$NAME: TRIMETHYLSILYL 8-METHYLNONANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₂₈O₂Si
CH$EXACT_MASS: 244.18586
CH$SMILES: CC(C)CCCCCCC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C13H28O2Si/c1-12(2)10-8-6-7-9-11-13(14)15-16(3,4)5/h12H,6-11H2,1-5H3
CH$LINK: INCHIKEY RPEGLTSXQCBJRY-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$SPLASH: splash10-00b9-9440000000-f462a4b55dbc93e9f19d
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  43 26.5 265
  45 12.1 121
  47 5.9 59
  55 1.08 11
  56 5.5 55
  58 5.3 53
  61 5.1 51
  69 1.14 11
  71 5.1 51
  73 99.99 999
  74 8.9 89
  75 8.12 81
  76 6.1 61
  77 11.9 119
  81 11.4 114
  83 0.61 6
  95 6.3 63
  97 5.3 53
  116 4.8 48
  117 7.63 76
  118 8.2 82
  129 31.2 312
  130 4.6 46
  131 2.08 21
  132 22.9 229
  133 5.3 53
  145 17.2 172
  185 0.51 5
  201 8.7 87
  229 79.3 793
  230 14.4 144
  231 4.8 48
//