MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010780
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010780
RECORD_TITLE: METHYL LAURATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: METHYL LAURATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H26O2
CH$EXACT_MASS: 214.19328
CH$SMILES: CCCCCCCCCCCC(=O)OC
CH$IUPAC: InChI=1S/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-12H2,1-2H3
CH$LINK: INCHIKEY
UQDUPQYQJKYHQI-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5026889
AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00di-9200000000-d7feee2adedcaba28d5f
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
43 4.1 41
55 2.3 23
57 3.6 36
59 0.18 2
69 2.7 27
71 1.8 18
74 99.99 999
75 1.49 15
83 1.8 18
84 2.3 23
85 1.4 14
87 4.53 45
88 6.3 63
97 2.3 23
98 1.8 18
101 0.5 5
115 3.6 36
129 5.4 54
140 1.4 14
143 1.04 10
144 1.4 14
157 2.7 27
171 7.2 72
172 0.14 1
183 4.1 41
185 3.2 32
214 10.9 109
215 2.3 23
//