MassBank Record: JP000563



 OCTANOIC ACID TRIMETHYLSILYL ESTER; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000563
RECORD_TITLE: OCTANOIC 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$NAME: OCTANOIC ACID TRIMETHYLSILYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H24O2Si CH$EXACT_MASS: 216.15456 CH$SMILES: CCCCCCCC(=O)O[Si](C)(C)C CH$IUPAC: InChI=1S/C11H24O2Si/c1-5-6-7-8-9-10-11(12)13-14(2,3)4/h5-10H2,1-4H3 CH$LINK: CAS 55494-06-9
AC$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: splash10-0umi-9550000000-506e27dc447a93122bb5 PK$NUM_PEAK: 18 PK$PEAK: m/z int. rel.int. 43 8.8 88 45 8.4 84 55 12.6 126 67 0.84 8 73 68.3 683 74 9.8 98 75 86.9 869 76 0.88 9 109 8 80 117 53.5 535 118 8.4 84 129 2.07 21 131 23.9 239 132 19.7 197 145 11.9 119 201 99.99 999 202 18.6 186 203 8.4 84 //