ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007906
RECORD_TITLE: 6,8-DIMETHYL-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$NAME: 6,8-DIMETHYL-4-OXO-4H-PYRIDO(1,2-A)PYRIMIDINE-3-ACETIC ACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₆N₂O₃
CH$EXACT_MASS: 260.11609
CH$SMILES: CCOC(=O)CC(=C2)C(=O)N(C(C)=1)C(=N2)C=C(C)C1
CH$IUPAC: InChI=1S/C14H16N2O3/c1-4-19-13(17)7-11-8-15-12-6-9(2)5-10(3)16(12)14(11)18/h5-6,8H,4,7H2,1-3H3
CH$LINK: INCHIKEY IAENEZBDQUPXCU-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$SPLASH: splash10-000i-1920000000-3f2822161ec8e805fe12
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  39 4.1 41
  41 1.3 13
  42 1 10
  51 0.13 1
  52 1.8 18
  53 2.6 26
  65 1.5 15
  66 0.15 2
  77 5.6 56
  78 2.3 23
  79 7.7 77
  79.5 0.21 2
  80 1.8 18
  93 1 10
  93.5 2.6 26
  94 0.32 3
  95 2.3 23
  104 1.5 15
  105 1.9 19
  106 2.38 24
  107 4 40
  122 11.3 113
  133 2.6 26
  157 0.35 4
  158 1.4 14
  159 12.6 126
  160 2.1 21
  173 0.14 1
  186 13.7 137
  187 99.99 999
  188 14.9 149
  189 0.12 1
  214 3.3 33
  215 4.2 42
  260 30 300
  261 4.7 47
//