ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003052
RECORD_TITLE: 2-CHLORO-1,1,1,4,4,4-HEXAFLUORO-2-BUTENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: 2-CHLORO-1,1,1,4,4,4-HEXAFLUORO-2-BUTENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4HClF6
CH$EXACT_MASS: 197.96710
CH$SMILES: FC(F)(F)C=C(Cl)C(F)(F)F
CH$IUPAC: InChI=1S/C4HClF6/c5-2(4(9,10)11)1-3(6,7)8/h1H/b2-1-
CH$LINK: INCHIKEY JRENXZBKMHPULY-UPHRSURJSA-N
AC$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$SPLASH: splash10-00or-8900000000-06fcdfd2e21e946b222f
PK$NUM_PEAK: 71
PK$PEAK: m/z int. rel.int.
  31 27.5 275
  35 1.7 17
  36 1.1 11
  37 0.19 2
  38 0.2 2
  47 1.4 14
  48 0.1 1
  49 0.04 0
  50 3.7 37
  51 4.7 47
  55 3.9 39
  56 0.45 5
  57 0.2 2
  59 0.3 3
  60 3.3 33
  61 0.02 0
  62 2 20
  63 0.5 5
  66 0.9 9
  67 0.03 0
  68 0.4 4
  69 97.7 977
  70 1.2 12
  71 0.02 0
  72 0.2 2
  74 4.2 42
  75 33.7 337
  76 0.11 1
  78 0.2 2
  79 0.6 6
  80 1.9 19
  81 0.07 1
  82 0.3 3
  85 5.6 56
  87 1.9 19
  90 0.04 0
  91 1 10
  92 0.2 2
  93 9.1 91
  94 0.27 3
  97 0.2 2
  98 1.4 14
  109 3.7 37
  110 0.13 1
  111 1.2 12
  112 1 10
  113 24.8 248
  114 0.07 1
  116 0.4 4
  118 0.1 1
  124 0.7 7
  125 0.02 0
  129 99.99 999
  130 3 30
  131 33.3 333
  132 0.11 1
  143 0.6 6
  144 0.5 5
  147 2.4 24
  148 0.96 10
  149 1 10
  150 3.1 31
  151 0.1 1
  163 0.96 10
  164 0.4 4
  179 21.1 211
  180 0.8 8
  181 0.68 7
  182 0.3 3
  198 34 340
  200 11.3 113
//
