ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003668
RECORD_TITLE: 1,2,3,4,7,7-HEXAFLUORO-5-VINYLBICYCLO(2.2.1)HEPT-2-ENE; 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$NAME: 1,2,3,4,7,7-HEXAFLUORO-5-VINYLBICYCLO(2.2.1)HEPT-2-ENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₆F₆
CH$EXACT_MASS: 228.03737
CH$SMILES: C=CC(C1)C(F)(C(F)=2)C(F)(F)C(F)1C(F)2
CH$IUPAC: InChI=1S/C9H6F6/c1-2-4-3-7(12)5(10)6(11)8(4,13)9(7,14)15/h2,4H,1,3H2
CH$LINK: INCHIKEY JIQFYEPIIGAPMW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID90337498

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$SPLASH: splash10-0udi-9300000000-f93ef1b4db26d95c16d6
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  27 4.2 42
  31 2.7 27
  39 19.4 194
  41 0.27 3
  51 5.1 51
  53 6.8 68
  54 99.99 999
  55 0.47 5
  57 2.9 29
  59 15.5 155
  69 6.3 63
  75 0.04 0
  77 2.8 28
  81 2.9 29
  88 1.6 16
  93 0.03 0
  95 3 30
  97 1.9 19
  99 2.3 23
  101 0.32 3
  113 2.2 22
  115 2.4 24
  119 4.4 44
  124 0.49 5
  127 3.6 36
  132 2.7 27
  133 5 50
  137 0.22 2
  145 3 30
  150 2.6 26
  151 4.9 49
  158 0.22 2
  159 4.9 49
  163 7.7 77
  164 4 40
  169 1.31 13
  174 4.9 49
  177 2.2 22
  181 10.3 103
  182 0.74 7
  187 1.9 19
  189 1.7 17
  208 6.5 65
  228 9.4 94
//