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5-nitrobarbituric acid
SpectraBase Compound ID wqgIEFtMEQ
InChI InChI=1S/C4H3N3O5/c8-2-1(7(11)12)3(9)6-4(10)5-2/h1H,(H2,5,6,8,9,10)
InChIKey ABICJYZKIYUWEE-UHFFFAOYSA-N
Mol Weight 173.08 g/mol
Molecular Formula C4H3N3O5
Exact Mass 173.00727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DT841lgyOcy
Name 5-Nitro-2,4,6(1H,3H,5H)-pyrimidinetrione
CAS Registry Number 480-68-2
Comments Less than 3 mono-isotopic peaks
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Formula C4H3N3O5
InChI InChI=1S/C4H3N3O5/c8-2-1(7(11)12)3(9)6-4(10)5-2/h1H,(H2,5,6,8,9,10)
InChIKey ABICJYZKIYUWEE-UHFFFAOYSA-N
Molecular Weight 173.084 g/mol
SMILES N1C(=O)NC(C(C1=O)N(=O)=O)=O
SPLASH splash10-00di-0900000000-e16ac1a9c62d5d9e5426
Source of Spectrum J-60-5502-18
Synonyms 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-nitro- 5-nitro-1,3-diazinane-2,4,6-trione 5-Nitro-6-hydroxyuracil 5-Nitrobarbituric acid 5-nitrohexahydropyrimidine-2,4,6-trione Barbituric acid, 5-nitro- Dilituric acid AI3-08858 BRN 0180758 EINECS 207-557-0 NSC 5071
Wiley ID 1169558