MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003422
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003422
RECORD_TITLE: BROMOCHLOROMETHANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA
CH$NAME: BROMOCHLOROMETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: CH2BrCl
CH$EXACT_MASS: 127.90284
CH$SMILES: ClCBr
CH$IUPAC: InChI=1S/CH2BrCl/c2-1-3/h1H2
CH$LINK: INCHIKEY
JPOXNPPZZKNXOV-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4021503
AC$INSTRUMENT: JEOL JMS-01-SG-2
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-000t-9500000000-be507a2d78074848a9a7
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
44 5.4 54
45 25.3 253
47 9.5 95
49 99.99 999
51 32.5 325
73 9 90
74 8.5 85
81 0.9 9
88 9.5 95
89 4 40
93 20.8 208
95 1.58 16
128 52 520
130 65.6 656
132 16.2 162
//
system version 2.2.8-SNAPSHOT