MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002297
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002297
RECORD_TITLE: 1,2-DIBROMOPROPANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 1,2-DIBROMOPROPANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H6Br2
CH$EXACT_MASS: 199.88363
CH$SMILES: CC(Br)CBr
CH$IUPAC: InChI=1S/C3H6Br2/c1-3(5)2-4/h3H,2H2,1H3
CH$LINK: INCHIKEY
XFNJYAKDBJUJAJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID60870403
AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-00di-2900000000-a83b2d0cd5fbc0e93991
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
41 35.87 359
42 3.04 30
43 1.85 19
45 1.83 18
77 1.28 13
79 1.07 11
81 1.18 12
82 1.32 13
93 3.35 34
95 3.11 31
105 1.77 18
107 3.99 40
109 1.89 19
112 2.28 23
117 1.5 15
119 1.91 19
121 99.99 999
122 4.17 42
123 99.94 999
124 3.62 36
187 1.03 10
200 1.59 16
202 2.76 28
204 1.32 13
//
system version 2.2.8-SNAPSHOT