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MassBank Record: JP008793

BENZENE; EI-B; MS

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

ACCESSION: JP008793
RECORD_TITLE: BENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UOEH
LICENSE: CC BY-NC-SA

CH$NAME: BENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H6
CH$EXACT_MASS: 78.04695
CH$SMILES: c(c1)cccc1
CH$IUPAC: InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
CH$LINK: INCHIKEY UHOVQNZJYSORNB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3039242

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$SPLASH: splash10-0fb9-9000000000-2aae37aac9f2a02d5e8b
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  36 1.82 18
  37 6.5 65
  38 7.38 74
  39 15.17 152
  49 6.91 69
  50 19.13 191
  51 25.18 252
  52 20.47 205
  61 2.61 26
  62 9.85 99
  63 6.45 65
  64 3.76 38
  73 2.58 26
  74 7.34 73
  75 2.37 24
  76 5.9 59
  77 22.89 229
  78 99.99 999
  79 7.4 74
//

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