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BUTYL-2-CYANO-2-(1,2,3,4-TETRAHYDRO-4-OXOTHIENO-[3,2-D]-PYRIDIN-2-YLIDENE)-ACETATE
SpectraBase Compound ID IroaeaXmZPR
InChI InChI=1S/C13H13N3O3S/c1-2-3-5-19-13(18)8(7-14)11-15-9-4-6-20-10(9)12(17)16-11/h4,6,15H,2-3,5H2,1H3,(H,16,17)/b11-8-
InChIKey ZBEWANIWZLLLHF-FLIBITNWSA-N
Mol Weight 291.32 g/mol
Molecular Formula C13H13N3O3S
Exact Mass 291.067762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BFJShrcOALj
Name BUTYL-2-CYANO-2-(1,2,3,4-TETRAHYDRO-4-OXOTHIENO-[3,2-D]-PYRIDIN-2-YLIDENE)-ACETATE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13N3O3S
InChI InChI=1S/C13H13N3O3S/c1-2-3-5-19-13(18)8(7-14)11-15-9-4-6-20-10(9)12(17)16-11/h4,6,15H,2-3,5H2,1H3,(H,16,17)/b11-8-
InChIKey ZBEWANIWZLLLHF-FLIBITNWSA-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 291.325 g/mol
Solvent DMSO-D6
Source File Reference UWVP5630