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5-(3-nitrobenzylidene)barbituric acid
SpectraBase Compound ID DQ6Sg2aUYWG
InChI InChI=1S/C11H7N3O5/c15-9-8(10(16)13-11(17)12-9)5-6-2-1-3-7(4-6)14(18)19/h1-5H,(H2,12,13,15,16,17)
InChIKey BRGHLSCNAIQJPE-UHFFFAOYSA-N
Mol Weight 261.19 g/mol
Molecular Formula C11H7N3O5
Exact Mass 261.03857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9OwOSbzt5dG
Name 5-(3-nitrobenzylidene)barbituric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7N3O5
InChI InChI=1S/C11H7N3O5/c15-9-8(10(16)13-11(17)12-9)5-6-2-1-3-7(4-6)14(18)19/h1-5H,(H2,12,13,15,16,17)
InChIKey BRGHLSCNAIQJPE-UHFFFAOYSA-N
Molecular Weight 261.193 g/mol
SMILES N1C(=O)NC(C(C1=O)=Cc1cc(N(=O)=O)ccc1)=O
SPLASH splash10-01ox-2970000000-42b0cb08032ae54f1bf7
Source of Spectrum HC-20-797-0
Synonyms 5-[(3-nitrophenyl)methylene]hexahydropyrimidine-2,4,6-trione 5-[(3-nitrophenyl)methylidene]-1,3-diazinane-2,4,6-trione
Wiley ID 1264528