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3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionic acid
SpectraBase Compound ID 2iuK9EzcNMF
InChI InChI=1S/C8H10N2O3S/c1-4-5(2-3-6(11)12)7(13)10-8(14)9-4/h2-3H2,1H3,(H,11,12)(H2,9,10,13,14)
InChIKey XXPAJXVOQAZZJC-UHFFFAOYSA-N
Mol Weight 214.24 g/mol
Molecular Formula C8H10N2O3S
Exact Mass 214.041213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EgnT6Cfq0F
Name 3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10N2O3S
InChI InChI=1S/C8H10N2O3S/c1-4-5(2-3-6(11)12)7(13)10-8(14)9-4/h2-3H2,1H3,(H,11,12)(H2,9,10,13,14)
InChIKey XXPAJXVOQAZZJC-UHFFFAOYSA-N
Molecular Weight 214.239 g/mol
SMILES N1C(=C(CCC(O)=O)C(NC1=S)=O)C
SPLASH splash10-02t9-7930000000-abf7bb07176357e6fd16
Synonyms 3-(6-Methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid 3-(6-Methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoic acid 3-(6-Methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanoic acid Propionic acid, 3-(6-methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-
Wiley ID 1441654