MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007919

1-OXO-1H-PYRIMIDO(1,2-A)QUINOLINE-2-ACETICACID ETHYL ESTER; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007919
RECORD_TITLE: 1-OXO-1H-PYRIMIDO(1,2-A)QUINOLINE-2-ACETICACID 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

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CH$NAME: 1-OXO-1H-PYRIMIDO(1,2-A)QUINOLINE-2-ACETICACID ETHYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₁₄N₂O₃
CH$EXACT_MASS: 282.10044
CH$SMILES: CCOC(=O)CC(=C([H])3)C(=O)N(c21)C(=N3)C([H])=C([H])c(cccc2)1
CH$IUPAC: InChI=1S/C16H14N2O3/c1-2-21-15(19)9-12-10-17-14-8-7-11-5-3-4-6-13(11)18(14)16(12)20/h3-8,10H,2,9H2,1H3
CH$LINK: INCHIKEY GKZJDLVDRPMCOY-UHFFFAOYSA-N

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4i-0290000000-786ca2e498d86897f8f6
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  55 3.1 31
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  77 2.6 26
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  129 4.3 43
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//