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METHYL_4,6-DIMETHYL-2-THIOXO-1,2,3,6-TETRAHYDROPYRIDINE-5-CARBOXYLATE
SpectraBase Compound ID DjSYyImmggF
InChI InChI=1S/C9H13NO2S/c1-5-4-7(13)10-6(2)8(5)9(11)12-3/h6H,4H2,1-3H3,(H,10,13)/t6-/m1/s1
InChIKey KOWXSFGJMGOVEJ-ZCFIWIBFSA-N
Mol Weight 199.27 g/mol
Molecular Formula C9H13NO2S
Exact Mass 199.0667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDO53tNiyrl
Name METHYL_4,6-DIMETHYL-2-THIOXO-1,2,3,6-TETRAHYDROPYRIDINE-5-CARBOXYLATE
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13NO2S
InChI InChI=1S/C9H13NO2S/c1-5-4-7(13)10-6(2)8(5)9(11)12-3/h6H,4H2,1-3H3,(H,10,13)/t6-/m1/s1
InChIKey KOWXSFGJMGOVEJ-ZCFIWIBFSA-N
Literature Reference Author S.BHATIA,D.BUCKLEY,R.W.MCCABE,P.B.HITCHCOCK
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1101(1998)
Literature Reference DOI 10.1039/a707521i
Molecular Weight 199.268 g/mol
Solvent CDCl3
Source File Reference UWBS784