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(5Z)-5-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzylidene]-1-(p-tolyl)barbituric acid
SpectraBase Compound ID 2lNiK5QnJqz
InChI InChI=1S/C29H27BrN2O6/c1-17-5-8-21(9-6-17)32-28(34)23(27(33)31-29(32)35)14-20-15-24(30)26(25(16-20)36-4)38-12-11-37-22-10-7-18(2)19(3)13-22/h5-10,13-16H,11-12H2,1-4H3,(H,31,33,35)/b23-14-
InChIKey QXXUKFGKNBIPFK-UCQKPKSFSA-N
Mol Weight 579.45 g/mol
Molecular Formula C29H27BrN2O6
Exact Mass 578.10525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eUhPWo0KO
Name (5Z)-5-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzylidene]-1-(p-tolyl)barbituric acid
Alternate Name(s) (5Z)-5-[[3-bromanyl-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione (5Z)-5-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylene]-1-(p-tolyl)hexahydropyrimidine-2,4,6-trione (5Z)-5-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl]methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione
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Formula C29H27BrN2O6
InChI InChI=1S/C29H27BrN2O6/c1-17-5-8-21(9-6-17)32-28(34)23(27(33)31-29(32)35)14-20-15-24(30)26(25(16-20)36-4)38-12-11-37-22-10-7-18(2)19(3)13-22/h5-10,13-16H,11-12H2,1-4H3,(H,31,33,35)/b23-14-
InChIKey QXXUKFGKNBIPFK-UCQKPKSFSA-N
Molecular Weight 579.447 g/mol
SMILES N1C(\C(C(N(C1=O)c1ccc(cc1)C)=O)=C/c1cc(Br)c(c(c1)OC)OCCOc1cc(C)c(cc1)C)=O
SPLASH splash10-001j-1900040000-ea1d0182387113610e61
Wiley ID 1436553