ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007892
RECORD_TITLE: 9-HYDROXY-4-OXO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-ACETIC 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$NAME: 9-HYDROXY-4-OXO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-ACETIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₂N₂O₄
CH$EXACT_MASS: 248.07971
CH$SMILES: CCOC(=O)CC(=C2)C(=O)N(C=1)C(=N2)C(O)=CC1
CH$IUPAC: InChI=1S/C12H12N2O4/c1-2-18-10(16)6-8-7-13-11-9(15)4-3-5-14(11)12(8)17/h3-5,7,15H,2,6H2,1H3
CH$LINK: INCHIKEY MONGEZKNMGDLAX-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$SPLASH: splash10-004i-1920000000-121c5db7ef422b863103
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  39 7.8 78
  53 1.9 19
  55 5.8 58
  65 0.17 2
  66 3.9 39
  67 2.2 22
  87.5 2.1 21
  94 1.25 13
  95 2.2 22
  121 7.5 75
  147 7.8 78
  175 99.99 999
  176 11.4 114
  177 1 10
  191 2.4 24
  203 0.42 4
  248 37.5 375
  249 5 50
//