ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004497
RECORD_TITLE: 1-METHYL-4-OXO-7,8-DIHYDRO-1H,4H,6H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXYLIC ACID ETHYLESTER; 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$NAME: 1-METHYL-4-OXO-7,8-DIHYDRO-1H,4H,6H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXYLIC ACID ETHYLESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H16N2O3
CH$EXACT_MASS: 236.11609
CH$SMILES: CCOC(=O)C(=C([H])1)C(=O)N(C2)C(=C([H])CC2)N(C)1
CH$IUPAC: InChI=1S/C12H16N2O3/c1-3-17-12(16)9-8-13(2)10-6-4-5-7-14(10)11(9)15/h6,8H,3-5,7H2,1-2H3
CH$LINK: INCHIKEY RHEPHABEOUOQOY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID90702268
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$SPLASH: splash10-000i-2790000000-7947eed6d704ae17e5c7
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  69 11 110
  81 10 100
  82 35 350
  83 0.3 3
  134 17 170
  135 15 150
  136 21 210
  150 0.6 6
  163 18 180
  176 8 80
  177 40 400
  178 0.8 8
  189 14 140
  190 9 90
  191 17 170
  207 0.9 9
  221 12 120
  235 60 600
  236 99.99 999
  237 14 140
//
