ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000022
RECORD_TITLE: 2-CHLOROPHENOL; 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

CH$NAME: 2-CHLOROPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₅ClO
CH$EXACT_MASS: 128.00289
CH$SMILES: Oc(c1)c(Cl)ccc1
CH$IUPAC: InChI=1S/C6H5ClO/c7-5-3-1-2-4-6(5)8/h1-4,8H
CH$LINK: INCHIKEY ISPYQTSUDJAMAB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5021544

AC$INSTRUMENT: VARIAN MAT-44
AC$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$SPLASH: splash10-01t9-9600000000-1d4acee3d22a14a5db15
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  51 4.31 43
  53 10.98 110
  60 3.19 32
  61 9.55 96
  62 16.81 168
  63 53.6 536
  64 76.56 766
  65 31.54 315
  66 4.85 49
  72 3.89 39
  73 9.88 99
  74 5.43 54
  75 5.31 53
  91 3.99 40
  92 21.81 218
  93 3.28 33
  94 2.33 23
  99 7.59 76
  100 9.63 96
  101 2.9 29
  102 3.03 30
  127 39.38 394
  128 99.99 999
  129 15.53 155
  130 31.15 312
  131 2.31 23
//