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(5E)-5-[5-bromo-2-[2-(3-ethyl-5-methyl-phenoxy)ethoxy]benzylidene]-1-(m-tolyl)barbituric acid
SpectraBase Compound ID HbrOG3ThRg5
InChI InChI=1S/C29H27BrN2O5/c1-4-20-12-19(3)14-24(15-20)36-10-11-37-26-9-8-22(30)16-21(26)17-25-27(33)31-29(35)32(28(25)34)23-7-5-6-18(2)13-23/h5-9,12-17H,4,10-11H2,1-3H3,(H,31,33,35)/b25-17+
InChIKey FEQDTRSDJFBIHP-KOEQRZSOSA-N
Mol Weight 563.45 g/mol
Molecular Formula C29H27BrN2O5
Exact Mass 562.110335 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcaSsozHT0w
Name (5E)-5-[5-bromo-2-[2-(3-ethyl-5-methyl-phenoxy)ethoxy]benzylidene]-1-(m-tolyl)barbituric acid
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Formula C29H27BrN2O5
InChI InChI=1S/C29H27BrN2O5/c1-4-20-12-19(3)14-24(15-20)36-10-11-37-26-9-8-22(30)16-21(26)17-25-27(33)31-29(35)32(28(25)34)23-7-5-6-18(2)13-23/h5-9,12-17H,4,10-11H2,1-3H3,(H,31,33,35)/b25-17+
InChIKey FEQDTRSDJFBIHP-KOEQRZSOSA-N
Molecular Weight 563.448 g/mol
SMILES N1C(\C(C(N(C1=O)c1cc(C)ccc1)=O)=C\c1c(ccc(c1)Br)OCCOc1cc(C)cc(c1)CC)=O
SPLASH splash10-0019-5917120000-c943876a1f3002e9240a
Synonyms (5E)-5-[[5-bromanyl-2-[2-(3-ethyl-5-methyl-phenoxy)ethoxy]phenyl]methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione (5E)-5-[[5-bromo-2-[2-(3-ethyl-5-methyl-phenoxy)ethoxy]phenyl]methylene]-1-(m-tolyl)hexahydropyrimidine-2,4,6-trione (5E)-5-[[5-bromo-2-[2-(3-ethyl-5-methylphenoxy)ethoxy]phenyl]methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Wiley ID 1436582