ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007498
RECORD_TITLE: NICOTINIC 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$NAME: NICOTINIC ACID TRIMETHYLSILYL ESTER
CH$NAME: PYRIDINE-3-CARBOXYLIC ACID TRIMETHYLSILYLESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₃NO₂Si
CH$EXACT_MASS: 195.07156
CH$SMILES: O=C(O[Si](C)(C)C)c(c1)cncc1
CH$IUPAC: InChI=1S/C9H13NO2Si/c1-13(2,3)12-9(11)8-5-4-6-10-7-8/h4-7H,1-3H3
CH$LINK: INCHIKEY PYFBRRMHOWLGJH-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID90334280

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$SPLASH: splash10-001i-1900000000-71213d84caada266e7d8
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  43 1.6 16
  44 3.2 32
  45 5.5 55
  47 0.39 4
  50 2.6 26
  51 15.6 156
  52 1.6 16
  53 0.06 1
  59 1.6 16
  72 1.6 16
  73 1.3 13
  74 0.16 2
  75 1.9 19
  76 0.6 6
  77 1.3 13
  78 3.62 36
  79 2.6 26
  90 2.9 29
  106 43.4 434
  107 0.26 3
  136 47.7 477
  137 5.5 55
  138 1.3 13
  180 99.99 999
  181 13.7 137
  182 4.2 42
  186 0.6 6
  194 0.06 1
  195 5.2 52
  196 0.6 6
//