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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011408

6-METHYL-3-(TRIMETHYLSILYL)METHYL-1-HEPTEN-4-OL; CI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011408
RECORD_TITLE: 6-METHYL-3-(TRIMETHYLSILYL)METHYL-1-HEPTEN-4-OL; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, INSTITUTE FOR CHEMICAL REACTION SCIENCE TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 6-METHYL-3-(TRIMETHYLSILYL)METHYL-1-HEPTEN-4-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H26OSi
CH$EXACT_MASS: 214.17529
CH$SMILES: CC(C)CC(O)C(C=C)C[Si](C)(C)C
CH$IUPAC: InChI=1S/C12H26OSi/c1-7-11(9-14(4,5)6)12(13)8-10(2)3/h7,10-13H,1,8-9H2,2-6H3
CH$LINK: INCHIKEY XMDRTAVKUHDSRY-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-DX-300
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-00di-9400000000-141c792e7d90ed5990b5
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  55 5.9 59
  57 6.4 64
  67 13.1 131
  68 2.1 21
  69 36.5 365
  70 2.7 27
  73 99.99 999
  74 12.2 122
  75 62.7 627
  76 5.6 56
  77 3.2 32
  81 7.8 78
  82 2.5 25
  83 12.9 129
  87 4.6 46
  91 13.3 133
  93 5 50
  95 4.5 45
  97 4.6 46
  103 2.5 25
  109 7 70
  123 16.4 164
  124 2.8 28
  125 5.9 59
  127 3 30
  128 5.4 54
  129 2.3 23
  131 6.2 62
  133 2.3 23
  141 7.9 79
  143 3.2 32
  147 3.3 33
  149 3.1 31
  157 2.3 23
  159 8.3 83
  163 3.7 37
  181 9 90
  197 37.8 378
  198 8.3 83
  199 10.8 108
//

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