ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007910
RECORD_TITLE: 7-CHLORO-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$NAME: 7-CHLORO-4-OXO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-ACETIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H11ClN2O3
CH$EXACT_MASS: 266.04582
CH$SMILES: CCOC(=O)CC(=C1)C(=O)N(C=2)C(C=CC(Cl)2)=N1
CH$IUPAC: InChI=1S/C12H11ClN2O3/c1-2-18-11(16)5-8-6-14-10-4-3-9(13)7-15(10)12(8)17/h3-4,6-7H,2,5H2,1H3
CH$LINK: INCHIKEY UGSTZPVMZHXYRW-UHFFFAOYSA-N
AC$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: splash10-0006-0920000000-bedc4f48081c106c095b
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  39 2.4 24
  50 1.1 11
  55 9.8 98
  76 0.7 7
  77 1.5 15
  78 1.7 17
  82.5 1.3 13
  96.5 0.13 1
  112 18.5 185
  113 3.3 33
  114 5.7 57
  139 0.57 6
  141 1.7 17
  165 6.5 65
  166 1.6 16
  167 0.23 2
  193 99.99 999
  194 13 130
  195 32.6 326
  196 0.37 4
  221 4.3 43
  233 1.3 13
  266 26.1 261
  267 0.37 4
  268 8 80
  269 1.1 11
//
