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3-pyridinecarboxamide, 4-(4-butoxyphenyl)-5-cyano-6-[[2-(3,4-dihydroxyphenyl)-2-oxoethyl]thio]-2-methyl-N-phenyl-
SpectraBase Compound ID AyHfcmiOulB
InChI InChI=1S/C32H29N3O5S/c1-3-4-16-40-24-13-10-21(11-14-24)30-25(18-33)32(41-19-28(38)22-12-15-26(36)27(37)17-22)34-20(2)29(30)31(39)35-23-8-6-5-7-9-23/h5-15,17,36-37H,3-4,16,19H2,1-2H3,(H,35,39)
InChIKey ZWBRFLDKYBYWHC-UHFFFAOYSA-N
Mol Weight 567.7 g/mol
Molecular Formula C32H29N3O5S
Exact Mass 567.182792 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ECN4T5ht13Z
Name 3-pyridinecarboxamide, 4-(4-butoxyphenyl)-5-cyano-6-[[2-(3,4-dihydroxyphenyl)-2-oxoethyl]thio]-2-methyl-N-phenyl-
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/C32H29N3O5S/c1-3-4-16-40-24-13-10-21(11-14-24)30-25(18-33)32(41-19-28(38)22-12-15-26(36)27(37)17-22)34-20(2)29(30)31(39)35-23-8-6-5-7-9-23/h5-15,17,36-37H,3-4,16,19H2,1-2H3,(H,35,39)
InChIKey ZWBRFLDKYBYWHC-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_2309
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/9253020; Labnumber: DVD-0000004
Temperature 303 °C