MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000572
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000572
RECORD_TITLE: OCTADECANOIC 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$NAME: OCTADECANOIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C21H44O2Si
CH$EXACT_MASS: 356.31106
CH$SMILES: CCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C21H44O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h5-20H2,1-4H3
CH$LINK: CAS
18748-91-9
CH$LINK: INCHIKEY
DDLPZVTUKLKVQB-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID90940209
AC$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: splash10-00xr-9600000000-b8666b4a871511e0a1cd
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
43 30.6 306
55 25.4 254
57 16.9 169
67 1.01 10
69 11.1 111
73 99.99 999
74 10 100
75 6.33 63
117 83.2 832
129 35.1 351
131 10.6 106
132 3.52 35
145 17.9 179
341 16.6 166
356 2 20
//