ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004456
RECORD_TITLE: 1H-PYRIMIDO(1,2-A)QUINOLIN-1-ONE; 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$NAME: 1H-PYRIMIDO(1,2-A)QUINOLIN-1-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H8N2O
CH$EXACT_MASS: 196.06366
CH$SMILES: [H]C(N=3)=C([H])C(=O)N(C31)c(c2)c(ccc2)C([H])=C([H])1
CH$IUPAC: InChI=1S/C12H8N2O/c15-12-7-8-13-11-6-5-9-3-1-2-4-10(9)14(11)12/h1-8H
CH$LINK: INCHIKEY AWTLDKNXRRLNGA-UHFFFAOYSA-N
AC$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: splash10-00mk-0900000000-cd78e5d4aa79d52fd79d
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  77 9.4 94
  84 9.2 92
  98 5.8 58
  101 2.6 26
  102 8.5 85
  114 8.2 82
  128 66 660
  129 1.2 12
  141 4.8 48
  149 6.2 62
  168 99.99 999
  169 1.3 13
  195 6 60
  196 92 920
  197 12 120
//
