MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000592

2,4-DIMETHYLBENZOIC ACID TRIMETHYLSILYL ESTER; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000592
RECORD_TITLE: 2,4-DIMETHYLBENZOIC 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

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CH$NAME: 2,4-DIMETHYLBENZOIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₈O₂Si
CH$EXACT_MASS: 222.10761
CH$SMILES: Cc(c1)cc(C)c(c1)C(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C12H18O2Si/c1-9-6-7-11(10(2)8-9)12(13)14-15(3,4)5/h6-8H,1-5H3
CH$LINK: INCHIKEY MYTFEBMPQUXFJH-UHFFFAOYSA-N

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-001i-2910000000-49bdde97d7a8054550bc
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  45 13.5 135
  73 10.9 109
  77 13.5 135
  79 1.41 14
  96 9.7 97
  103 9.2 92
  104 9.5 95
  105 2.19 22
  132 24.2 242
  133 99.99 999
  163 39.4 394
  207 4.84 48
  208 11.2 112
  222 12.1 121
//