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5-[(E)-3-(4-ketochromen-3-yl)prop-2-enylidene]barbituric acid
SpectraBase Compound ID rZdrdzQnxf
InChI InChI=1S/C16H10N2O5/c19-13-9(8-23-12-7-2-1-5-10(12)13)4-3-6-11-14(20)17-16(22)18-15(11)21/h1-8H,(H2,17,18,20,21,22)/b4-3+
InChIKey SARBGMZDABSEEL-ONEGZZNKSA-N
Mol Weight 310.26 g/mol
Molecular Formula C16H10N2O5
Exact Mass 310.058971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NRwvhWDqVt
Name 5-[(E)-3-(4-ketochromen-3-yl)prop-2-enylidene]barbituric acid
Alternate Name(s) 5-[(E)-3-(4-oxidanylidenechromen-3-yl)prop-2-enylidene]-1,3-diazinane-2,4,6-trione 5-[(E)-3-(4-oxo-1-benzopyran-3-yl)prop-2-enylidene]-1,3-diazinane-2,4,6-trione 5-[(E)-3-(4-oxochromen-3-yl)prop-2-enylidene]-1,3-diazinane-2,4,6-trione 5-[(E)-3-(4-oxochromen-3-yl)prop-2-enylidene]hexahydropyrimidine-2,4,6-trione 5-[3-(4-Oxo-4H-chromen-3-yl)-allylidene]-pyrimidine-2,4,6-trione
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Formula C16H10N2O5
InChI InChI=1S/C16H10N2O5/c19-13-9(8-23-12-7-2-1-5-10(12)13)4-3-6-11-14(20)17-16(22)18-15(11)21/h1-8H,(H2,17,18,20,21,22)/b4-3+
InChIKey SARBGMZDABSEEL-ONEGZZNKSA-N
Molecular Weight 310.265 g/mol
SMILES N1C(NC(C(C1=O)=C\C=C\C=1C(c2ccccc2OC1)=O)=O)=O
SPLASH splash10-03di-3955000000-099586e53c12db49542c
Wiley ID 1466118