ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007921
RECORD_TITLE: 2-HEPTAFLUOROPROPYL-5-TRIFLUOROMETHYLBENZMIDAZOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MAKI Y, GOVERMENT INDUSTRIAL RESEARCH INSTITUTE, NAGOYA
LICENSE: CC BY-NC-SA
CH$NAME: 2-HEPTAFLUOROPROPYL-5-TRIFLUOROMETHYLBENZMIDAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H4F10N2
CH$EXACT_MASS: 354.02148
CH$SMILES: C1=CC2=C(C=C1C(F)(F)F)NC(=N2)C(C(C(F)(F)F)(F)F)(F)F
CH$IUPAC: InChI=1S/C11H4F10N2/c12-8(13,10(17,18)11(19,20)21)7-22-5-2-1-4(9(14,15)16)3-6(5)23-7/h1-3H,(H,22,23)
CH$LINK: INCHIKEY CUIYQHZRAVZIPS-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0f79-3795000000-b3210b04fc12480780a7
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  44 25.74 257
  51 3.36 34
  67 3.52 35
  69 18.86 189
  100 18.15 182
  119 22.57 226
  131 40.39 404
  150 1.6 16
  163 4.17 42
  167 2.64 26
  169 16.63 166
  170 4.79 48
  197 2.04 20
  208 5.58 56
  215 7.72 77
  216 2.1 21
  234 1.34 13
  235 99.99 999
  236 10.74 107
  266 1.11 11
  286 1.47 15
  335 12.97 130
  336 1.68 17
  354 55.04 550
  355 7.08 71
//
