MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000949

CHLOROBENZENE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000949
RECORD_TITLE: CHLOROBENZENE; 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

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CH$NAME: CHLOROBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₅Cl
CH$EXACT_MASS: 112.00798
CH$SMILES: Clc(c1)cccc1
CH$IUPAC: InChI=1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H
CH$LINK: CAS 108-90-7
CH$LINK: INCHIKEY MVPPADPHJFYWMZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4020298

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AC$INSTRUMENT: JEOL JMS-01-SG
AC$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$SPLASH: splash10-03fr-9700000000-82e784dca91e262a7e4d
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  37 5.2 52
  38 7.3 73
  39 2.6 26
  45 1.19 12
  49 4.6 46
  50 25 250
  51 25.8 258
  56 0.31 3
  61 2.2 22
  73 6.1 61
  74 11.4 114
  75 0.97 10
  76 6.2 62
  77 67.6 676
  78 4.4 44
  89 0.32 3
  112 99.99 999
  113 7 70
  114 31.4 314
//