MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007194
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007194
RECORD_TITLE: METHYL DECANOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: METHYL DECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H22O2
CH$EXACT_MASS: 186.16198
CH$SMILES: CCCCCCCCCC(=O)OC
CH$IUPAC: InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3
CH$LINK: INCHIKEY
YRHYCMZPEVDGFQ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4026842
AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-00dl-9000000000-e9af40c8b9364ca00540
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
15 4.02 40
27 8.71 87
29 11.62 116
39 6.13 61
41 22.69 227
42 5.99 60
43 22.11 221
45 1.3 13
53 1.63 16
54 1.01 10
55 16.42 164
56 2.78 28
57 7.36 74
59 10.03 100
67 1.42 14
69 8.31 83
70 1.38 14
71 2.69 27
73 1.51 15
74 99.99 999
75 10.02 100
83 2.57 26
84 2.47 25
85 1.46 15
87 47.67 477
88 4.96 50
97 1.8 18
98 1.54 15
101 5.23 52
115 1.06 11
129 2.69 27
143 10.85 109
144 1.03 10
155 7.5 75
157 1.57 16
186 1.95 20
//