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1-Benzyl-6-(4-chlorocoumarin-3-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
SpectraBase Compound ID D4YNzSLvJKp
InChI InChI=1S/C22H13ClN2O3/c23-20-16-8-4-5-9-18(16)28-22(27)19(20)17-11-10-15(12-24)21(26)25(17)13-14-6-2-1-3-7-14/h1-11H,13H2
InChIKey FYHPVAVFNFWAHB-UHFFFAOYSA-N
Mol Weight 388.81 g/mol
Molecular Formula C22H13ClN2O3
Exact Mass 388.06147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcnRyLhRFzy
Name 1-Benzyl-6-(4-chlorocoumarin-3-yl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
Appearance Pale yellow crystals
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Formula C22H13ClN2O3
InChI InChI=1S/C22H13ClN2O3/c23-20-16-8-4-5-9-18(16)28-22(27)19(20)17-11-10-15(12-24)21(26)25(17)13-14-6-2-1-3-7-14/h1-11H,13H2
InChIKey FYHPVAVFNFWAHB-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3811
Molecular Weight 388.810 g/mol
SMILES C1(C(=CC=C(N1Cc1ccccc1)C=1C(Oc2ccccc2C1Cl)=O)C#N)=O
SPLASH splash10-00or-9402000000-10c516388ec9df1c1c17
Source of Spectrum Y-57-720-7
Wiley ID 1860034