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MassBank Record: JP002904

P-CHLOROPHENOL; EI-B; MS

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

ACCESSION: JP002904
RECORD_TITLE: P-CHLOROPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: P-CHLOROPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H5ClO
CH$EXACT_MASS: 128.00289
CH$SMILES: Oc(c1)ccc(Cl)c1
CH$IUPAC: InChI=1S/C6H5ClO/c7-5-1-3-6(8)4-2-5/h1-4,8H
CH$LINK: INCHIKEY WXNZTHHGJRFXKQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1021871

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-004i-9800000000-3a8b74727039919cacc4
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  18 2.23 22
  31 2.24 22
  32 2.28 23
  37 5.97 60
  38 7.7 77
  39 15.47 155
  46 4.41 44
  49 2.52 25
  50 5.33 53
  51 2.58 26
  53 4.81 48
  55 2.04 20
  61 4.76 48
  62 6.57 66
  63 12.44 124
  64 17.41 174
  65 33.08 331
  66 3.54 35
  73 7.64 76
  74 3.12 31
  75 4.74 47
  92 2.79 28
  93 4.15 42
  99 6.09 61
  100 10.32 103
  101 3.03 30
  102 4.19 42
  128 99.99 999
  129 7.26 73
  130 34.22 342
  131 2.27 23
//

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