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6-ETHYL-4-METHYL-2-THIOXO-1,2-DIHYDROPYRIMIDINE-5-CARBONITRILE
SpectraBase Compound ID J1nQPOleCJ3
InChI InChI=1S/C8H9N3S/c1-3-7-6(4-9)5(2)10-8(12)11-7/h3H2,1-2H3,(H,10,11,12)
InChIKey ZKGVWUNWCUGZCQ-UHFFFAOYSA-N
Mol Weight 179.24 g/mol
Molecular Formula C8H9N3S
Exact Mass 179.051718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KqWzmCFi8Xc
Name 6-ETHYL-4-METHYL-2-THIOXO-1,2-DIHYDROPYRIMIDINE-5-CARBONITRILE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9N3S
InChI InChI=1S/C8H9N3S/c1-3-7-6(4-9)5(2)10-8(12)11-7/h3H2,1-2H3,(H,10,11,12)
InChIKey ZKGVWUNWCUGZCQ-UHFFFAOYSA-N
Literature Reference Author H.G.MCFADDEN,J.L.HUPPATZ
Literature Reference Citation AUSTR.J.CHEM.,45,1045(1992)
Literature Reference DOI 10.1071/ch9921045
Molecular Weight 179.240 g/mol
Solvent DMSO-D6
Source File Reference UWVP5199