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5-[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-benzylidene]barbituric acid
SpectraBase Compound ID Gc2XuNRKAie
InChI InChI=1S/C24H25BrN2O6/c1-24(2,3)15-5-7-16(8-6-15)32-9-10-33-20-18(25)12-14(13-19(20)31-4)11-17-21(28)26-23(30)27-22(17)29/h5-8,11-13H,9-10H2,1-4H3,(H2,26,27,28,29,30)
InChIKey CYBDYYAQWYUADC-UHFFFAOYSA-N
Mol Weight 517.38 g/mol
Molecular Formula C24H25BrN2O6
Exact Mass 516.0896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CzV0b3f5dn
Name 5-[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-benzylidene]barbituric acid
Alternate Name(s) 5-[[3-bromanyl-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-phenyl]methylidene]-1,3-diazinane-2,4,6-trione 5-[[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-phenyl]methylene]hexahydropyrimidine-2,4,6-trione 5-[[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl]methylidene]-1,3-diazinane-2,4,6-trione
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Formula C24H25BrN2O6
InChI InChI=1S/C24H25BrN2O6/c1-24(2,3)15-5-7-16(8-6-15)32-9-10-33-20-18(25)12-14(13-19(20)31-4)11-17-21(28)26-23(30)27-22(17)29/h5-8,11-13H,9-10H2,1-4H3,(H2,26,27,28,29,30)
InChIKey CYBDYYAQWYUADC-UHFFFAOYSA-N
Molecular Weight 517.376 g/mol
SMILES N1C(NC(C(C1=O)=Cc1cc(Br)c(c(c1)OC)OCCOc1ccc(C(C)(C)C)cc1)=O)=O
SPLASH splash10-0uxr-2300090000-6b732dcf521608e2d851
Wiley ID 1436551