MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006462
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006462
RECORD_TITLE: BUTYL FORMATE; 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$NAME: BUTYL FORMATE
CH$NAME: FORMIC ACID BUTYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H10O2
CH$EXACT_MASS: 102.06808
CH$SMILES: CCCCOC=O
CH$IUPAC: InChI=1S/C5H10O2/c1-2-3-4-7-5-6/h5H,2-4H2,1H3
CH$LINK: INCHIKEY
NMJJFJNHVMGPGM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2060468
AC$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: splash10-0a6u-9000000000-69a6b7dc8e0c0a8fb002
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
15 1.88 19
18 3.08 31
19 1.12 11
26 3.85 39
27 28.38 284
28 13.97 140
29 32.3 323
30 1.42 14
31 51.43 514
32 1.14 11
38 1.45 15
39 14.28 143
40 3.12 31
41 55.71 557
42 8.47 85
43 18.43 184
44 3.02 30
45 6.45 65
47 3.24 32
53 1.06 11
55 10.56 106
56 99.99 999
57 8.04 80
59 1.79 18
60 2.48 25
73 6.49 65
//