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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000618

16-METHYLOCTADECANOIC ACID TRIMETHYLSILYLESTER; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000618
RECORD_TITLE: 16-METHYLOCTADECANOIC ACID TRIMETHYLSILYLESTER; 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$NAME: 16-METHYLOCTADECANOIC ACID TRIMETHYLSILYLESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C22H46O2Si
CH$EXACT_MASS: 370.32671
CH$SMILES: CCC(C)CCCCCCCCCCCCCCC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C22H46O2Si/c1-6-21(2)19-17-15-13-11-9-7-8-10-12-14-16-18-20-22(23)24-25(3,4)5/h21H,6-20H2,1-5H3
CH$LINK: INCHIKEY HNKZWPWPYTXLNR-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$SPLASH: splash10-01e9-7900000000-9b779faac6d78a75c86a
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  43 18 180
  55 19.2 192
  57 13 130
  69 1.2 12
  73 64.1 641
  75 45 450
  76 6 60
  81 0.64 6
  83 8.9 89
  95 6.8 68
  97 8.2 82
  98 0.87 9
  117 99.99 999
  118 13.2 132
  129 37.7 377
  130 0.64 6
  131 14.5 145
  132 49.1 491
  133 9.5 95
  145 3.79 38
  146 7.8 78
  201 15.9 159
  355 12.6 126
  370 6.09 61
  371 4.9 49
//

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