ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007900
RECORD_TITLE: 4-BROMO-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$NAME: 4-BROMO-6-(4-FLUOROPHENYL)PYRIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H6BrFN2
CH$EXACT_MASS: 251.96984
CH$SMILES: Fc(c2)ccc(c2)c(n1)cc(Br)nc1
CH$IUPAC: InChI=1S/C10H6BrFN2/c11-10-5-9(13-6-14-10)7-1-3-8(12)4-2-7/h1-6H
CH$LINK: INCHIKEY VVLXBRIIRDGDMQ-UHFFFAOYSA-N
AC$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: splash10-0002-1930000000-1885c31f8ecf2946c2bf
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  50 1.7 17
  52 1.3 13
  57 1.2 12
  60 0.1 1
  62 1 10
  63 1.5 15
  73 2.6 26
  74 0.24 2
  75 5.5 55
  86.5 2.1 21
  91 1.7 17
  94 0.25 3
  95 6.5 65
  99 3.7 37
  112.5 1.7 17
  113.5 0.16 2
  118 1.6 16
  120 2.6 26
  121 1.8 18
  122 0.11 1
  123 3 30
  126 20.2 202
  127 2.4 24
  145 0.25 3
  146 99.99 999
  147 8.6 86
  173 15.2 152
  174 0.13 1
  198 3.6 36
  199 3.4 34
  200 3.5 35
  201 0.27 3
  208 1.9 19
  252 48.3 483
  253 5.3 53
  254 4.85 49
  255 5.3 53
//
