MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000569
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000569
RECORD_TITLE: PENTADECANOIC 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$NAME: PENTADECANOIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H38O2Si
CH$EXACT_MASS: 314.26411
CH$SMILES: CCCCCCCCCCCCCCC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C18H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-21(2,3)4/h5-17H2,1-4H3
CH$LINK: INCHIKEY
SHDTWSQDHLKGEO-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID40335202
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$SPLASH: splash10-00vl-9300000000-6f7de1f221ae383e1914
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
43 99.99 999
45 11.3 113
47 8.2 82
55 2.66 27
57 13.6 136
69 12.9 129
73 97.1 971
74 0.74 7
75 84.7 847
77 18 180
117 74.4 744
129 2.71 27
131 12.6 126
132 29.1 291
145 20.6 206
298 1.26 13
299 22.4 224
//
system version 2.2.8-SNAPSHOT