ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007894
RECORD_TITLE: 1,6-DIMETHYL-4-OXO-7,8-DIHYDRO-1H,4H,6H-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$NAME: 1,6-DIMETHYL-4-OXO-7,8-DIHYDRO-1H,4H,6H-PYRIDO(1,2-A)PYRIMIDINE-3-CARBOXYLIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H18N2O3
CH$EXACT_MASS: 250.13174
CH$SMILES: CCOC(=O)C(=C([H])1)C(=O)N(C(C)2)C(=C([H])CC2)N(C)1
CH$IUPAC: InChI=1S/C13H18N2O3/c1-4-18-13(17)10-8-14(3)11-7-5-6-9(2)15(11)12(10)16/h7-9H,4-6H2,1-3H3
CH$LINK: INCHIKEY AEKDFTDASFSIAS-UHFFFAOYSA-N
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0udi-3590000000-48c0527e45db89444a16
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  65 4 40
  66 3 30
  67 11.4 114
  68 1.1 11
  80 11 110
  81 11 110
  82 22 220
  83 1.4 14
  84 7 70
  94 5 50
  95 10 100
  96 0.6 6
  107 5 50
  108 7 70
  109 4 40
  110 1.3 13
  133 6 60
  135 4 40
  136 14 140
  147 0.9 9
  148 19 190
  149 19 190
  150 13 130
  163 1.5 15
  175 5 50
  176 5 50
  177 9 90
  189 1.1 11
  196 6 60
  203 13 130
  204 7 70
  205 1.5 15
  207 7 70
  209 8 80
  221 13 130
  235 2.5 25
  236 4 40
  249 32 320
  250 99.99 999
  251 16 160
//
