ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000344
RECORD_TITLE: 4-METHYL-2-PHENYLPURIMIDINE; 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$NAME: 4-METHYL-2-PHENYLPURIMIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₀N₂
CH$EXACT_MASS: 170.08440
CH$SMILES: Cc(c2)nc(nc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C11H10N2/c1-9-7-8-12-11(13-9)10-5-3-2-4-6-10/h2-8H,1H3
CH$LINK: INCHIKEY XPENFJAKMNONFL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60344619

AC$INSTRUMENT: HITACHI RMU-6D
AC$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$SPLASH: splash10-0fk9-2900000000-ad4fb214c4ef3efd5f6e
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  39 19 190
  51 14 140
  52 6 60
  67 1.3 13
  76 19 190
  77 17 170
  103 68 680
  104 0.23 2
  129 14 140
  155 25 250
  169 14 140
  170 99.99 999
  171 18 180
//