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METHYL-2-CYANO-2-(1,2,3,4-TETRAHYDRO-4-OXOTHIENO-[3,2-D]-PYRIDIN-2-YLIDENE)-ACETATE
SpectraBase Compound ID FnAXEbqbqJS
InChI InChI=1S/C10H7N3O3S/c1-16-10(15)5(4-11)8-12-6-2-3-17-7(6)9(14)13-8/h2-3,12H,1H3,(H,13,14)/b8-5-
InChIKey BUYIRJCMWQFZLD-YVMONPNESA-N
Mol Weight 249.24 g/mol
Molecular Formula C10H7N3O3S
Exact Mass 249.020812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AoNawNKU6jz
Name METHYL-2-CYANO-2-(1,2,3,4-TETRAHYDRO-4-OXOTHIENO-[3,2-D]-PYRIDIN-2-YLIDENE)-ACETATE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H7N3O3S
InChI InChI=1S/C10H7N3O3S/c1-16-10(15)5(4-11)8-12-6-2-3-17-7(6)9(14)13-8/h2-3,12H,1H3,(H,13,14)/b8-5-
InChIKey BUYIRJCMWQFZLD-YVMONPNESA-N
Literature Reference Author R.NEIDLEIN,Z.SUI
Literature Reference Citation HELV.CHIM.ACTA,74,579(1991)
Literature Reference DOI 10.1002/hlca.19910740315
Molecular Weight 249.244 g/mol
Solvent DMSO-D6
Source File Reference UWVP5632