MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001821
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001821
RECORD_TITLE: BUTYL CHLORIDE; 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$NAME: BUTYL CHLORIDE
CH$NAME: 1-CHLOROBUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H9Cl
CH$EXACT_MASS: 92.03928
CH$SMILES: CCCCCl
CH$IUPAC: InChI=1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3
CH$LINK: INCHIKEY
VFWCMGCRMGJXDK-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8020206
AC$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: splash10-0a6u-9000000000-0350104e9b48c471c55a
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
26 3.46 35
27 27.85 279
28 15.23 152
29 19.54 195
31 1.23 12
38 1.38 14
39 10.69 107
40 2.31 23
41 62.46 625
42 4.92 49
43 33.23 332
49 2.38 24
51 1.54 15
55 8.15 82
56 99.99 999
57 9.92 99
62 1.62 16
63 5.85 59
65 1.62 16
//
system version 2.2.8-SNAPSHOT