MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001799
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001799
RECORD_TITLE: METHYL PROPIONATE; 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$NAME: METHYL PROPIONATE
CH$NAME: PROPIONIC ACID METHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H8O2
CH$EXACT_MASS: 88.05243
CH$SMILES: CCC(=O)OC
CH$IUPAC: InChI=1S/C4H8O2/c1-3-4(5)6-2/h3H2,1-2H3
CH$LINK: INCHIKEY
RJUFJBKOKNCXHH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7027201
AC$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: splash10-0a6r-9000000000-f392ce5fb6b0153ccdfe
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
15 12.58 126
18 1.12 11
26 3.15 32
27 13.56 136
28 7.87 79
29 65.92 659
30 2.17 22
31 3.82 38
45 2.92 29
55 3.97 40
56 3.07 31
57 99.99 999
58 3.45 35
59 29.96 300
60 1.05 11
87 2.17 22
88 28.91 289
89 2.4 24
//