MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008872
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008872
RECORD_TITLE: PROPYL FORMATE; 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$NAME: PROPYL FORMATE
CH$NAME: FORMIC ACID PROPYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H8O2
CH$EXACT_MASS: 88.05243
CH$SMILES: CCCOC=O
CH$IUPAC: InChI=1S/C4H8O2/c1-2-3-6-4-5/h4H,2-3H2,1H3
CH$LINK: INCHIKEY
KFNNIILCVOLYIR-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3059391
AC$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: splash10-000x-9000000000-172df0b26fbf2ba1be88
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
15 1.61 16
26 2.5 25
27 17.75 178
28 6.24 62
29 13.65 137
30 1.96 20
31 97.23 972
39 7.85 79
40 2.94 29
41 23.19 232
42 99.99 999
43 14.18 142
45 2.77 28
47 10.08 101
57 5.35 54
59 5.17 52
73 1.25 13
//