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(Z)-(4-Methyl-3-oxo-2,3,4,5,6,7-hexahydro-thieno(2,3-B)pyridin-6-ylidene)-acetic acid, methyl ester
SpectraBase Compound ID 1mlOAmiWL3G
InChI InChI=1S/C11H13NO3S/c1-6-3-7(4-9(14)15-2)12-11-10(6)8(13)5-16-11/h4,6,12H,3,5H2,1-2H3/b7-4-
InChIKey RZMDAJDYPOWCRZ-DAXSKMNVSA-N
Mol Weight 239.29 g/mol
Molecular Formula C11H13NO3S
Exact Mass 239.061614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJdR5HFElTF
Name (Z)-(4-Methyl-3-oxo-2,3,4,5,6,7-hexahydro-thieno(2,3-B)pyridin-6-ylidene)-acetic acid, methyl ester
CAS Registry Number 72139-66-3
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Formula C11H13NO3S
InChI InChI=1S/C11H13NO3S/c1-6-3-7(4-9(14)15-2)12-11-10(6)8(13)5-16-11/h4,6,12H,3,5H2,1-2H3/b7-4-
InChIKey RZMDAJDYPOWCRZ-DAXSKMNVSA-N
Literature Reference A. Gossauer, F. Roessler, L. Ernst, Liebigs Ann. Chem. 1309 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3