ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004483
RECORD_TITLE: 4-OXO-6,7,8,9-TETRAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXYLIC ACID ETHYL ESTER; 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$NAME: 4-OXO-6,7,8,9-TETRAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXYLIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₄N₂O₃
CH$EXACT_MASS: 222.10044
CH$SMILES: CCOC(=O)C(=C1)C(=O)N(C2)C(CCC2)=N1
CH$IUPAC: InChI=1S/C11H14N2O3/c1-2-16-11(15)8-7-12-9-5-3-4-6-13(9)10(8)14/h7H,2-6H2,1H3
CH$LINK: INCHIKEY GRBTZPKCTXIBMP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30343710

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$SPLASH: splash10-0udi-2900000000-648117fab40dd1f6f72f
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  53 10 100
  55 15 150
  67 8 80
  82 2.5 25
  148 3 30
  149 5 50
  150 99.99 999
  151 1 10
  161 1.5 15
  165 1 10
  176 15 150
  177 7 70
  222 12 120
  223 2 20
//