ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003055
RECORD_TITLE: 2,3-DICHLORO-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$NAME: 2,3-DICHLORO-1,1,1,4,4,4-HEXAFLUORO-2-BUTENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4Cl2F6
CH$EXACT_MASS: 231.92812
CH$SMILES: FC(F)(F)C(Cl)=C(Cl)C(F)(F)F
CH$IUPAC: InChI=1S/C4Cl2F6/c5-1(3(7,8)9)2(6)4(10,11)12/b2-1-
CH$LINK: INCHIKEY XDIDQEGAKCWQQP-UPHRSURJSA-N
AC$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$SPLASH: splash10-03xs-6930000000-ab6ed26609ad9426d1e3
PK$NUM_PEAK: 57
PK$PEAK: m/z int. rel.int.
  31 10.4 104
  35 1.4 14
  37 0.4 4
  47 0.2 2
  49 0.7 7
  50 2 20
  55 5.1 51
  59 0.01 0
  62 1.2 12
  66 1.4 14
  68 0.4 4
  69 99.99 999
  70 1.4 14
  74 9.6 96
  78 1.4 14
  80 0.04 0
  85 10.2 102
  87 3.7 37
  90 2 20
  93 3.11 31
  94 3.4 34
  96 1.2 12
  97 0.8 8
  98 0.07 1
  109 19.2 192
  110 1.1 11
  111 6.3 63
  112 0.51 5
  124 2.4 24
  128 1.5 15
  130 0.8 8
  132 0.05 1
  143 2.8 28
  147 34 340
  148 1.5 15
  149 1.13 11
  150 0.5 5
  163 96.7 967
  164 3.9 39
  165 0.61 6
  166 2.7 27
  167 9.6 96
  168 0.6 6
  182 0.36 4
  184 2.4 24
  186 0.6 6
  197 25.5 255
  199 0.85 9
  213 16.4 164
  215 10.7 107
  217 1.7 17
  232 7.12 71
  233 3.4 34
  234 45.8 458
  235 1.8 18
  236 0.73 7
  237 0.3 3
//
