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6-hydroxy-2-mercapto-4-pyrimidinecarboxylic acid
SpectraBase Compound ID 6oNT6I1aOas
InChI InChI=1S/C5H4N2O3S/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11)
InChIKey ISOQUWRYYNKKGX-UHFFFAOYSA-N
Mol Weight 172.16 g/mol
Molecular Formula C5H4N2O3S
Exact Mass 171.994263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9E62SbYDV4K
Name 6-Oxo-2-sulfanyl-1H-pyrimidine-4-carboxylic acid
Alternate Name(s) 2-Mercapto-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H4N2O3S
InChI InChI=1S/C5H4N2O3S/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11)
InChIKey ISOQUWRYYNKKGX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.825
Molecular Weight 172.158 g/mol
SMILES OC(C=1N=C(NC(C1)=O)S)=O
SPLASH splash10-00xr-6900000000-e24a0dc3b539eec12b5c
Source of Spectrum RCM-16-2045-5
Wiley ID 1819792