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5-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxy-benzylidene]barbituric acid
SpectraBase Compound ID GREgvWdZxfr
InChI InChI=1S/C23H23BrN2O6/c1-4-30-19-12-15(10-17-21(27)25-23(29)26-22(17)28)11-18(24)20(19)32-8-7-31-16-6-5-13(2)14(3)9-16/h5-6,9-12H,4,7-8H2,1-3H3,(H2,25,26,27,28,29)
InChIKey JZYNRIJOCYOYSY-UHFFFAOYSA-N
Mol Weight 503.35 g/mol
Molecular Formula C23H23BrN2O6
Exact Mass 502.073949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51pD0LdiCP0
Name 5-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxy-benzylidene]barbituric acid
Alternate Name(s) 5-[[3-bromanyl-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxy-phenyl]methylidene]-1,3-diazinane-2,4,6-trione 5-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxy-phenyl]methylene]hexahydropyrimidine-2,4,6-trione 5-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxyphenyl]methylidene]-1,3-diazinane-2,4,6-trione
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Formula C23H23BrN2O6
InChI InChI=1S/C23H23BrN2O6/c1-4-30-19-12-15(10-17-21(27)25-23(29)26-22(17)28)11-18(24)20(19)32-8-7-31-16-6-5-13(2)14(3)9-16/h5-6,9-12H,4,7-8H2,1-3H3,(H2,25,26,27,28,29)
InChIKey JZYNRIJOCYOYSY-UHFFFAOYSA-N
Molecular Weight 503.349 g/mol
SMILES N1C(NC(C(C1=O)=Cc1cc(Br)c(c(c1)OCC)OCCOc1cc(C)c(cc1)C)=O)=O
SPLASH splash10-0uka-4901030000-1a2e5a98a89681b4a4b0
Wiley ID 1436537