MassBank Record: JP000567



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

ACCESSION: JP000567
RECORD_TITLE: DODECANOIC 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$NAME: DODECANOIC ACID TRIMETHYLSILYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H32O2Si CH$EXACT_MASS: 272.21716 CH$SMILES: CCCCCCCCCCCC(=O)O[Si](C)(C)C CH$IUPAC: InChI=1S/C15H32O2Si/c1-5-6-7-8-9-10-11-12-13-14-15(16)17-18(2,3)4/h5-14H2,1-4H3 CH$LINK: CAS 55520-95-1
AC$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: splash10-00vl-9310000000-a00b1885215ace3170cb PK$NUM_PEAK: 28 PK$PEAK: m/z int. rel.int. 43 64.4 644 45 12.1 121 47 12.5 125 55 1.75 18 56 5 50 57 8.7 87 61 7.1 71 67 0.58 6 69 10.4 104 72 5 50 73 99.99 999 74 1.12 11 75 90.3 903 76 8.3 83 77 7.5 75 81 0.75 8 83 5.8 58 95 7.5 75 97 5 50 98 0.5 5 117 69.4 694 118 6.6 66 129 23 230 131 1.38 14 132 23.8 238 145 14.2 142 257 33.8 338 258 5.8 58 //