ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000965
RECORD_TITLE: 4-CHLOROPHENYL PHENYL ETHER; 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$NAME: 4-CHLOROPHENYL PHENYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H9ClO
CH$EXACT_MASS: 204.03419
CH$SMILES: Clc(c2)ccc(c2)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C12H9ClO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
CH$LINK: CAS 7005-72-3
CH$LINK: INCHIKEY PGPNJCAMHOJTEF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2052447
AC$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
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0udi-4590000000-3b9a6537774326d15431
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  50 10.3 103
  51 20.3 203
  62 3.2 32
  63 0.9 9
  64 2.4 24
  65 5.3 53
  70 5.1 51
  73 0.48 5
  74 5.3 53
  75 12.7 127
  76 2.9 29
  77 2.87 29
  78 2.2 22
  84 3.8 38
  99 6.1 61
  101 0.22 2
  111 3.2 32
  115 12.7 127
  128 3.4 34
  139 0.7 7
  140 2.2 22
  141 50 500
  142 7.2 72
  168 0.75 8
  169 11.5 115
  175 2.7 27
  176 6.4 64
  178 0.26 3
  204 99.99 999
  205 12 120
  206 36.9 369
  207 4.7 47
//
