MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001081
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001081
RECORD_TITLE: OCTADECANEDIOIC ACID BIS(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$NAME: OCTADECANEDIOIC ACID BIS(TRIMETHYLSILYL) ESTER
CH$NAME: DI(TRIMETHYLSILYL) OCTADECANEDIOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C24H50O4Si2
CH$EXACT_MASS: 458.32476
CH$SMILES: C(CCCCCCCCC(=O)O[Si](C)(C)C)CCCCCCCC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C24H50O4Si2/c1-29(2,3)27-23(25)21-19-17-15-13-11-9-7-8-10-12-14-16-18-20-22-24(26)28-30(4,5)6/h7-22H2,1-6H3
CH$LINK: INCHIKEY
VDMOBMJETWUJLJ-UHFFFAOYSA-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$SPLASH: splash10-00vi-9220000000-4b2cbc1de56492fa8f90
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
45 11.9 119
47 10.5 105
55 35.9 359
67 1.05 11
69 15.4 154
73 94.3 943
75 99.99 999
77 1.54 15
81 14 140
83 13.3 133
95 21.8 218
97 1.05 11
117 32.3 323
129 28.1 281
147 16.9 169
149 1.76 18
204 57 570
217 42.9 429
327 16.1 161
443 5.28 53
444 16.9 169
445 7.7 77
//