MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012090
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012090
RECORD_TITLE: 6-METHYL-6-VINYLDODECANE-5,8-DIONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, INSTITUTE FOR CHEMICAL REACTION SCIENCE TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 6-METHYL-6-VINYLDODECANE-5,8-DIONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H26O2
CH$EXACT_MASS: 238.19328
CH$SMILES: CCCCC(=O)CC(C)(C=C)C(=O)CCCC
CH$IUPAC: InChI=1S/C15H26O2/c1-5-8-10-13(16)12-15(4,7-3)14(17)11-9-6-2/h7H,3,5-6,8-12H2,1-2,4H3
CH$LINK: INCHIKEY
REOULBHPBOSYMQ-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-DX-300
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: splash10-052r-9100000000-9c4df35e6c188e35a7a5
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
39 1.9 19
41 13.1 131
42 1 10
43 1.9 19
53 1.4 14
55 2.5 25
57 61.5 615
58 3.1 31
67 1.9 19
68 1.9 19
85 99.99 999
86 6.6 66
94 1.5 15
97 2.1 21
138 12.5 125
139 2.1 21
153 8.7 87
154 1.7 17
181 1.3 13
238 3.7 37
//