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Isobarbituric acid
SpectraBase Compound ID K7BOhnpj06v
InChI InChI=1S/C4H4N2O3/c7-2-1-5-4(9)6-3(2)8/h1,7H,(H2,5,6,8,9)
InChIKey OFJNVANOCZHTMW-UHFFFAOYSA-N
Mol Weight 128.09 g/mol
Molecular Formula C4H4N2O3
Exact Mass 128.022192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8UNPvwN6Gdk
Name 2,4,5-Pyrimidinetriol
CAS Registry Number 20636-41-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4N2O3
InChI InChI=1S/C4H4N2O3/c7-2-1-5-4(9)6-3(2)8/h1,7H,(H2,5,6,8,9)
InChIKey OFJNVANOCZHTMW-UHFFFAOYSA-N
Molecular Weight 128.087 g/mol
SMILES Oc1cnc(O)nc1O
SPLASH splash10-004i-9300000000-9e30a113f9d32c86ed8e
Source of Spectrum NP-0-6831-0
Synonyms 2,4(1H,3H)-Pyrimidinedione, 5-hydroxy- 5-Hydroxyazouracil Isobarbituric acid 5-Hydroxy-1H-pyrimidine-2,4-dione 5-Oxidanyl-1H-pyrimidine-2,4-dione
Wiley ID 1096594