ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003649
RECORD_TITLE: 2,3-BIS(TRIFLUOROMETHYL)-5-METHYLTHIOPHENE; 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$NAME: 2,3-BIS(TRIFLUOROMETHYL)-5-METHYLTHIOPHENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H4F6S
CH$EXACT_MASS: 233.99379
CH$SMILES: Cc(c1)sc(C(F)(F)F)c1C(F)(F)F
CH$IUPAC: InChI=1S/C7H4F6S/c1-3-2-4(6(8,9)10)5(14-3)7(11,12)13/h2H,1H3
CH$LINK: INCHIKEY WCVINHVYPRPSFZ-UHFFFAOYSA-N
AC$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$SPLASH: splash10-0159-4970000000-d52fee25c8df202e2c67
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  31 3 30
  32 7.7 77
  39 6.6 66
  44 0.55 6
  45 14.3 143
  57 5.1 51
  59 7.6 76
  63 0.08 1
  69 18.7 187
  75 5.1 51
  93 5 50
  95 0.06 1
  101 7.7 77
  113 7.7 77
  115 12.1 121
  121 0.05 1
  145 4.9 49
  165 99.99 999
  166 7.2 72
  184 1.43 14
  215 29.7 297
  233 27.5 275
  234 57 570
  235 5 50
//
