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MassBank Record: JP004638

(4-BROMO-(E)-1-BUTENYL)BENZENE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP004638
RECORD_TITLE: (4-BROMO-(E)-1-BUTENYL)BENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KATO T, DEPT. OF CHEM., FAC. OF SCI., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (4-BROMO-(E)-1-BUTENYL)BENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H11Br
CH$EXACT_MASS: 210.00441
CH$SMILES: BrCCC([H])=C([H])c(c1)cccc1
CH$IUPAC: InChI=1S/C10H11Br/c11-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-8H,5,9H2/b8-4+
CH$LINK: CAS 7515-41-5
CH$LINK: INCHIKEY YENIUOKSTSIUOR-XBXARRHUSA-N

AC$INSTRUMENT: HITACHI M-52
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-066u-7900000000-29e3445af18bc1463f5c
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
  32 24.1 241
  40 3.6 36
  41 9.3 93
  42 0.23 2
  43 12.1 121
  44 5.1 51
  51 2 20
  53 0.15 2
  55 14.3 143
  56 2.9 29
  57 11.1 111
  58 0.35 4
  67 10.9 109
  68 1.2 12
  77 8.5 85
  78 0.36 4
  79 1.5 15
  81 8.3 83
  82 1.3 13
  85 1.88 19
  86 1.3 13
  91 37.6 376
  92 2.3 23
  103 0.12 1
  104 15.7 157
  105 13.7 137
  106 13.1 131
  107 0.19 2
  115 10.2 102
  116 5.8 58
  117 99.99 999
  118 0.76 8
  128 1.3 13
  129 3.8 38
  130 3.4 34
  131 0.73 7
  158 4.5 45
  159 8.2 82
  160 1.5 15
  238 1.37 14
  239 1.7 17
  240 13.7 137
  241 1.3 13
//

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