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5-(4-bromobenzylidene)barbituric acid
SpectraBase Compound ID BOhve1CJDNL
InChI InChI=1S/C11H7BrN2O3/c12-7-3-1-6(2-4-7)5-8-9(15)13-11(17)14-10(8)16/h1-5H,(H2,13,14,15,16,17)
InChIKey CQEQIOMGDJRDII-UHFFFAOYSA-N
Mol Weight 295.09 g/mol
Molecular Formula C11H7BrN2O3
Exact Mass 293.964005 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iYcTG3RtB8
Name 5-(4-bromobenzylidene)barbituric acid
Alternate Name(s) 5-[(4-bromophenyl)methylene]hexahydropyrimidine-2,4,6-trione 5-[(4-bromophenyl)methylidene]-1,3-diazinane-2,4,6-trione
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Formula C11H7BrN2O3
InChI InChI=1S/C11H7BrN2O3/c12-7-3-1-6(2-4-7)5-8-9(15)13-11(17)14-10(8)16/h1-5H,(H2,13,14,15,16,17)
InChIKey CQEQIOMGDJRDII-UHFFFAOYSA-N
Molecular Weight 295.092 g/mol
SMILES N1C(NC(C(C1=O)=Cc1ccc(cc1)Br)=O)=O
SPLASH splash10-0uxv-0290000000-0b3da741d5f256f8e3d0
Source of Spectrum SK-30-1299-3
Wiley ID 881202