MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006389
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006389
RECORD_TITLE: ALLYL PROPIONATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ALLYL PROPIONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H10O2
CH$EXACT_MASS: 114.06808
CH$SMILES: C=CCOC(=O)CC
CH$IUPAC: InChI=1S/C6H10O2/c1-3-5-8-6(7)4-2/h3H,1,4-5H2,2H3
CH$LINK: INCHIKEY
XRFWKHVQMACVTA-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0047668
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$SPLASH: splash10-0a6r-9000000000-225ad4314e5a35c22f50
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
15 1.12 11
26 3.85 39
27 16.12 161
28 3.84 38
29 41.22 412
30 1.1 11
31 1.35 14
38 1.48 15
39 15.16 152
40 2.42 24
41 32.46 325
42 2.44 24
55 1.6 16
56 1.86 19
57 99.99 999
58 4.42 44
75 1.77 18
//