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1,3-Dimethyl-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione
SpectraBase Compound ID IKqEpc43sv6
InChI InChI=1S/C13H11N3O6/c1-14-11(18)8(12(19)15(2)13(14)20)5-7-3-4-10(17)9(6-7)16(21)22/h3-6,17H,1-2H3
InChIKey FMJDOEIWGPNZSF-UHFFFAOYSA-N
Mol Weight 305.25 g/mol
Molecular Formula C13H11N3O6
Exact Mass 305.064785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLnL8tGYl9r
Name 1,3-Dimethyl-5-[(3-nitro-4-oxidanyl-phenyl)methylidene]-1,3-diazinane-2,4,6-trione
Alternate Name(s) 5-(4-hydroxy-3-nitro-benzylidene)-1,3-dimethyl-barbituric acid 5-[(4-hydroxy-3-nitro-phenyl)methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione 5-[(4-hydroxy-3-nitrophenyl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
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Formula C13H11N3O6
InChI InChI=1S/C13H11N3O6/c1-14-11(18)8(12(19)15(2)13(14)20)5-7-3-4-10(17)9(6-7)16(21)22/h3-6,17H,1-2H3
InChIKey FMJDOEIWGPNZSF-UHFFFAOYSA-N
Molecular Weight 305.246 g/mol
SMILES Oc1ccc(cc1N(=O)=O)C=C1C(N(C)C(N(C1=O)C)=O)=O
SPLASH splash10-0pb9-9622000000-203490d08418eee8dc7e
Wiley ID 1452841