ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007918
RECORD_TITLE: 1-OXO-1H-PYRIMIDO(1,2-A)QUINOLINE-2-CARBOXYLIC ACID PROPYL 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$NAME: 1-OXO-1H-PYRIMIDO(1,2-A)QUINOLINE-2-CARBOXYLIC ACID PROPYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₁₄N₂O₃
CH$EXACT_MASS: 282.10044
CH$SMILES: CCCOC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)C=C1
CH$IUPAC: InChI=1S/C16H14N2O3/c1-2-9-21-16(20)12-10-17-14-8-7-11-5-3-4-6-13(11)18(14)15(12)19/h3-8,10H,2,9H2,1H3
CH$LINK: INCHIKEY YTDVVJLYXSIROL-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$SPLASH: splash10-00pj-1950000000-a6d95291ab3ab5d3dc6c
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  64 12 120
  69 40 400
  77 8.2 82
  101 1.6 16
  119 12 120
  128 99.99 999
  129 24.8 248
  140 1.2 12
  155 8.9 89
  168 53 530
  169 15 150
  194 0.45 5
  195 23 230
  196 57 570
  197 8 80
  212 2.8 28
  213 4.5 45
  219 5.8 58
  223 58 580
  224 0.97 10
  240 17 170
  241 3.6 36
  254 4.2 42
  268 0.57 6
  282 75 750
  283 16 160
//