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3-pyridinecarboxylic acid, 5-cyano-4-(4-ethoxyphenyl)-1,2,3,4-tetrahydro-6-[(2-methoxy-2-oxoethyl)thio]-2-oxo-, methyl ester
SpectraBase Compound ID 2OsndGcva0k
InChI InChI=1S/C19H20N2O6S/c1-4-27-12-7-5-11(6-8-12)15-13(9-20)18(28-10-14(22)25-2)21-17(23)16(15)19(24)26-3/h5-8,15-16H,4,10H2,1-3H3,(H,21,23)
InChIKey NXIQDFDPUBDKJH-UHFFFAOYSA-N
Mol Weight 404.44 g/mol
Molecular Formula C19H20N2O6S
Exact Mass 404.104208 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IJ35uMtXx1k
Name 3-pyridinecarboxylic acid, 5-cyano-4-(4-ethoxyphenyl)-1,2,3,4-tetrahydro-6-[(2-methoxy-2-oxoethyl)thio]-2-oxo-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H20N2O6S/c1-4-27-12-7-5-11(6-8-12)15-13(9-20)18(28-10-14(22)25-2)21-17(23)16(15)19(24)26-3/h5-8,15-16H,4,10H2,1-3H3,(H,21,23)
InChIKey NXIQDFDPUBDKJH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2307
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/11238632