MassBank Record: JP002397



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

ACCESSION: JP002397
RECORD_TITLE: 2-TRIMETHYLSILYLHEXANOIC ACID; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2-TRIMETHYLSILYLHEXANOIC ACID CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H20O2Si CH$EXACT_MASS: 188.12326 CH$SMILES: CCCCC(C(O)=O)[Si](C)(C)C CH$IUPAC: InChI=1S/C9H20O2Si/c1-5-6-7-8(9(10)11)12(2,3)4/h8H,5-7H2,1-4H3,(H,10,11)
AC$INSTRUMENT: JEOL JMS-D-3000 AC$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$SPLASH: splash10-00fr-9600000000-ba8c404e796516741b49 PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 45 5.28 53 47 4.32 43 55 1.18 12 59 1.27 13 60 1.12 11 61 4.76 48 72 2.66 27 73 95.66 957 74 9.1 91 75 99.99 999 76 7.73 77 77 4.08 41 81 2.61 26 116 2.43 24 117 34.83 348 118 3.16 32 119 1.35 14 129 6.14 61 131 12.37 124 132 14.83 148 133 1.82 18 143 1.11 11 145 5.72 57 146 1.09 11 159 1.49 15 173 74.71 747 174 10.34 103 175 3.9 39 188 1.33 13 //