MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003421
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003421
RECORD_TITLE: DICHLOROBROMOMETHANE; 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$NAME: DICHLOROBROMOMETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: CHBrCl2
CH$EXACT_MASS: 161.86387
CH$SMILES: ClC(Cl)Br
CH$IUPAC: InChI=1S/CHBrCl2/c2-1(3)4/h1H
CH$LINK: INCHIKEY
FMWLUWPQPKEARP-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1020198
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$SPLASH: splash10-001r-9000000000-de1bb40194eeb1bf9907
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
47 24.7 247
48 16.9 169
49 9.6 96
50 5.9 59
79 6.4 64
81 6.6 66
83 99.99 999
84 0.66 7
85 80.9 809
86 4.3 43
87 11.8 118
91 0.36 4
127 11.3 113
129 14.4 144
131 3.6 36
//
system version 2.2.6-SNAPSHOT