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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008794

1,2-DIBROMOPROPANE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008794
RECORD_TITLE: 1,2-DIBROMOPROPANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
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$INSTRUMENT: HP 5970
AC$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$SPLASH: splash10-0076-9300000000-0ea9c767a7764678a1f1
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  36 1.35 14
  37 8.55 86
  38 14.78 148
  39 66.26 663
  40 8.57 86
  41 99.99 999
  42 8.16 82
  43 0.22 2
  79 7.9 79
  80 3.77 38
  81 7.86 79
  82 3.44 34
  83 0.28 3
  91 0.73 7
  92 0.59 6
  93 4.62 46
  94 0.7 7
  95 4.11 41
  96 0.1 1
  104 0.33 3
  105 1.66 17
  106 0.77 8
  107 2.41 24
  108 0.42 4
  109 0.78 8
  110 0.02 0
  115 0.03 0
  116 0.09 1
  117 0.2 2
  118 0.1 1
  119 0.62 6
  121 38.34 383
  123 37.72 377
  124 1.27 13
  125 0.02 0
  158 0.25 3
  160 0.46 5
  161 0.03 0
  162 0.24 2
  171 0.03 0
  184 0.02 0
  185 0.1 1
  186 0.04 0
  187 0.2 2
  189 0.1 1
  200 0.25 3
  201 0.04 0
  202 0.43 4
  204 0.18 2
//

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