ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004468
RECORD_TITLE: 4-CHLORO-6-(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$NAME: 4-CHLORO-6-(4-FLUOROPHENYL)PYRIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H6ClFN2
CH$EXACT_MASS: 208.02035
CH$SMILES: Fc(c2)ccc(c2)c(n1)cc(Cl)nc1
CH$IUPAC: InChI=1S/C10H6ClFN2/c11-10-5-9(13-6-14-10)7-1-3-8(12)4-2-7/h1-6H
CH$LINK: INCHIKEY KYBYBOZNMFRRSF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID80344818
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$SPLASH: splash10-0aba-1940000000-0d1d4616ea81add007e4
PK$NUM_PEAK: 57
PK$PEAK: m/z int. rel.int.
  39 0.7 7
  50 1.4 14
  51 0.7 7
  52 0.14 1
  57 1.4 14
  60 2.2 22
  61 0.7 7
  62 0.07 1
  63 1 10
  68 1 10
  73 2.4 24
  74 0.23 2
  75 6.8 68
  76 1.3 13
  77 0.7 7
  86 0.1 1
  86.5 0.7 7
  87 0.9 9
  88 0.5 5
  90.5 0.27 3
  91 0.5 5
  91.5 1 10
  92 0.5 5
  94 0.47 5
  95 7.5 75
  96 0.5 5
  99 3.7 37
  100 0.06 1
  104 2.5 25
  105 0.9 9
  118 1.7 17
  119 0.06 1
  120 4.7 47
  121 5.8 58
  122 2.4 24
  123 0.17 2
  126 18 180
  127 1.9 19
  140 0.5 5
  145 0.34 3
  146 62.4 624
  147 6.3 63
  148 0.5 5
  153 0.17 2
  171 0.5 5
  173 99.99 999
  174 9.5 95
  175 0.05 1
  180 0.5 5
  181 1.4 14
  182 0.5 5
  183 0.07 1
  207 1.3 13
  208 97 970
  209 10.4 104
  210 2.85 29
  211 2.9 29
//
