ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004441
RECORD_TITLE: 4-(4-FLUOROPHENYL)PYRIMIDINE; 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$NAME: 4-(4-FLUOROPHENYL)PYRIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H7FN2
CH$EXACT_MASS: 174.05933
CH$SMILES: Fc(c2)ccc(c2)c(c1)ncnc1
CH$IUPAC: InChI=1S/C10H7FN2/c11-9-3-1-8(2-4-9)10-5-6-12-7-13-10/h1-7H
CH$LINK: INCHIKEY DPALDESLDSLUGD-UHFFFAOYSA-N
AC$INSTRUMENT: MS-902
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00di-1900000000-2eedaad8b62eb7005f88
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  44 1.1 11
  49 0.7 7
  50 1.5 15
  52 0.14 1
  53 7.9 79
  54 0.7 7
  57 1.3 13
  60 0.15 2
  61 0.8 8
  62 1.3 13
  63 1.3 13
  68 0.09 1
  69 1.4 14
  73 0.8 8
  74 3.8 38
  75 0.25 3
  87 1.7 17
  94 4.6 46
  95 2.1 21
  96 0.09 1
  98 0.6 6
  99 2.6 26
  117 0.7 7
  118 0.07 1
  120 38.5 385
  121 11.8 118
  122 2.7 27
  123 0.08 1
  126 0.9 9
  127 0.8 8
  146 1.3 13
  147 6.11 61
  148 5.1 51
  149 0.7 7
  163 0.7 7
  173 5.19 52
  174 99.99 999
  175 12.3 123
//
