MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008776

1,3-DIBROMOBENZENE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008776
RECORD_TITLE: 1,3-DIBROMOBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
LICENSE: CC BY-NC-SA

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CH$NAME: 1,3-DIBROMOBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₄Br₂
CH$EXACT_MASS: 233.86798
CH$SMILES: Brc(c1)cc(Br)cc1
CH$IUPAC: InChI=1S/C6H4Br2/c7-5-2-1-3-6(8)4-5/h1-4H
CH$LINK: CAS 108-36-1
CH$LINK: INCHIKEY JSRLURSZEMLAFO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7051555

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0550-9460000000-e1704a5f18fb48e87971
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  49 11.09 111
  50 74.12 741
  51 6.95 70
  73 14.8 148
  74 52.57 526
  75 56.28 563
  76 44.38 444
  77 12.38 124
  78 9.63 96
  79 8.69 87
  81 12.48 125
  117 7.03 70
  118 7.4 74
  155 57.84 578
  156 7.67 77
  157 61.92 619
  234 62.77 628
  236 99.99 999
  237 7.28 73
  238 50.74 507
//