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3-pyridinecarboxylic acid, 5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-6-[(2-methoxy-2-oxoethyl)thio]-2-oxo-, methyl ester

View entire compound with spectra: 1 NMR

3-pyridinecarboxylic acid, 5-cyano-4-(2-ethoxyphenyl)-1,2,3,4-tetrahydro-6-[(2-methoxy-2-oxoethyl)thio]-2-oxo-, methyl ester
SpectraBase Compound ID 5mSRaLgNaOq
InChI InChI=1S/C19H20N2O6S/c1-4-27-13-8-6-5-7-11(13)15-12(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 MPBCWKKUIHHAEZ-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 4knZkDQY3VX
Name 3-pyridinecarboxylic acid, 5-cyano-4-(2-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/c1-4-27-13-8-6-5-7-11(13)15-12(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 MPBCWKKUIHHAEZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_2329
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/9253160; Labnumber: KR-0000012
Temperature 303 °C