ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002397
RECORD_TITLE: 2-TRIMETHYLSILYLHEXANOIC ACID; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2-TRIMETHYLSILYLHEXANOIC ACID
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₂₀O₂Si
CH$EXACT_MASS: 188.12326
CH$SMILES: CCCCC(C(O)=O)[Si](C)(C)C
CH$IUPAC: InChI=1S/C9H20O2Si/c1-5-6-7-8(9(10)11)12(2,3)4/h8H,5-7H2,1-4H3,(H,10,11)
CH$LINK: INCHIKEY YQQCMSGNERDIER-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-00fr-9600000000-ba8c404e796516741b49
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  45 5.28 53
  47 4.32 43
  55 1.18 12
  59 1.27 13
  60 1.12 11
  61 4.76 48
  72 2.66 27
  73 95.66 957
  74 9.1 91
  75 99.99 999
  76 7.73 77
  77 4.08 41
  81 2.61 26
  116 2.43 24
  117 34.83 348
  118 3.16 32
  119 1.35 14
  129 6.14 61
  131 12.37 124
  132 14.83 148
  133 1.82 18
  143 1.11 11
  145 5.72 57
  146 1.09 11
  159 1.49 15
  173 74.71 747
  174 10.34 103
  175 3.9 39
  188 1.33 13
//