MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002135
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002135
RECORD_TITLE: METHYL VINYL KETONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: METHYL VINYL KETONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H6O
CH$EXACT_MASS: 70.04186
CH$SMILES: C=CC(C)=O
CH$IUPAC: InChI=1S/C4H6O/c1-3-4(2)5/h3H,1H2,2H3
CH$LINK: INCHIKEY
FUSUHKVFWTUUBE-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3025671
AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0006-9000000000-ed02292aef1db44add36
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
15 8.13 81
27 13.74 137
28 17.41 174
29 5.04 50
39 11.3 113
40 2.76 28
41 43.41 434
42 5.85 59
43 99.99 999
44 29.19 292
45 2.44 24
50 1.63 16
51 3.17 32
52 1.63 16
53 8.29 83
54 2.11 21
55 24.39 244
56 1.63 16
57 2.44 24
65 3.66 37
67 12.44 124
68 2.44 24
69 12.76 128
70 5.53 55
71 2.36 24
//