ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007898
RECORD_TITLE: 2-(3-FLUOROPHENYL)-4-PHENYLPYRIMIDINE; 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$NAME: 2-(3-FLUOROPHENYL)-4-PHENYLPYRIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H11FN2
CH$EXACT_MASS: 250.09063
CH$SMILES: Fc(c3)cc(cc3)c(n2)nc(cc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C16H11FN2/c17-14-8-4-7-13(11-14)16-18-10-9-15(19-16)12-5-2-1-3-6-12/h1-11H
CH$LINK: INCHIKEY CZBRVZRPXXJFRX-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30347253
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$SPLASH: splash10-0udi-1890000000-ffc271b46ef35bbabddc
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  50 1.7 17
  51 2.7 27
  52 1.5 15
  55 0.11 1
  57 1.1 11
  63 1.5 15
  74 1.5 15
  75 0.31 3
  76 4.3 43
  77 3 30
  94 3.1 31
  95 0.19 2
  101 2.3 23
  102 29.9 299
  103 9.2 92
  115 0.19 2
  121 22.7 227
  122 1.7 17
  124 1.2 12
  125 0.7 7
  125.5 1.3 13
  128 3.9 39
  129 42.5 425
  130 0.4 4
  147 1.3 13
  222 1.1 11
  249 8.4 84
  250 99.99 999
  251 16.3 163
  252 1.3 13
//
