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3-pyridinecarboxylic acid, 4-(4-chlorophenyl)-6-[[(4-chlorophenyl)methyl]thio]-5-cyano-1,4-dihydro-2-methyl-, 1,1-dimethylethyl ester

View entire compound with spectra: 1 NMR

3-pyridinecarboxylic acid, 4-(4-chlorophenyl)-6-[[(4-chlorophenyl)methyl]thio]-5-cyano-1,4-dihydro-2-methyl-, 1,1-dimethylethyl ester
SpectraBase Compound ID GBViSumxDJa
InChI InChI=1S/C25H24Cl2N2O2S/c1-15-21(24(30)31-25(2,3)4)22(17-7-11-19(27)12-8-17)20(13-28)23(29-15)32-14-16-5-9-18(26)10-6-16/h5-12,22,29H,14H2,1-4H3
InChIKey DZRGHWXYVHMMJB-UHFFFAOYSA-N
Mol Weight 487.45 g/mol
Molecular Formula C25H24Cl2N2O2S
Exact Mass 486.093555 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CAidIwoSheu
Name 3-pyridinecarboxylic acid, 4-(4-chlorophenyl)-6-[[(4-chlorophenyl)methyl]thio]-5-cyano-1,4-dihydro-2-methyl-, 1,1-dimethylethyl 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/C25H24Cl2N2O2S/c1-15-21(24(30)31-25(2,3)4)22(17-7-11-19(27)12-8-17)20(13-28)23(29-15)32-14-16-5-9-18(26)10-6-16/h5-12,22,29H,14H2,1-4H3
InChIKey DZRGHWXYVHMMJB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2258
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/11238561