MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000581
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000581
RECORD_TITLE: ELAIDIC 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$NAME: ELAIDIC ACID TRIMETHYLSILYL ESTER
CH$NAME: TRANS-9-OCTADECENOIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C21H42O2Si
CH$EXACT_MASS: 354.29541
CH$SMILES: CCCCCCCCC=CCCCCCCCC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C21H42O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h12-13H,5-11,14-20H2,1-4H3/b13-12+
CH$LINK: INCHIKEY
GAODWSYPSJBKGB-OUKQBFOZSA-N
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$SPLASH: splash10-00vi-9300000000-1ccbce4559855c30bb9f
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
43 21.2 212
55 41.8 418
67 26.8 268
69 2.28 23
73 99.99 999
75 70.9 709
81 20 200
82 2.05 21
84 19.4 194
95 18.1 181
96 27.7 277
97 1.67 17
98 16.5 165
110 13.3 133
117 63 630
123 1 10
129 38.3 383
131 11.3 113
132 13.3 133
145 2.09 21
199 9.1 91
339 21.9 219
340 5.7 57
//