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5-(p-ethoxybenzylidene)-2-thioberbituric acid
SpectraBase Compound ID F8LYGRNTip6
InChI InChI=1S/C13H12N2O3S/c1-2-18-9-5-3-8(4-6-9)7-10-11(16)14-13(19)15-12(10)17/h3-7H,2H2,1H3,(H2,14,15,16,17,19)
InChIKey NPSBKPIWIVUDJS-UHFFFAOYSA-N
Mol Weight 276.31 g/mol
Molecular Formula C13H12N2O3S
Exact Mass 276.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YS6x4OhbsP
Name 5-(4-Ethoxybenzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O3S
InChI InChI=1S/C13H12N2O3S/c1-2-18-9-5-3-8(4-6-9)7-10-11(16)14-13(19)15-12(10)17/h3-7H,2H2,1H3,(H2,14,15,16,17,19)
InChIKey NPSBKPIWIVUDJS-UHFFFAOYSA-N
Molecular Weight 276.310 g/mol
SMILES N1C(NC(C(C1=O)=Cc1ccc(cc1)OCC)=O)=S
SPLASH splash10-004i-2290000000-1dd5328b8ef9e6c290b7
Source of Spectrum G-57-1154-0
Synonyms 5-[(4-ethoxyphenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione 5-[(4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Wiley ID 813245