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5-acetyl-2-[(2-chlorobenzyl)sulfanyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydro-3-pyridinecarbonitrile
SpectraBase Compound ID ocEr9ERnuZ
InChI InChI=1S/C22H18Cl2N2OS/c1-13-20(14(2)27)21(16-8-4-6-10-19(16)24)17(11-25)22(26-13)28-12-15-7-3-5-9-18(15)23/h3-10,21,26H,12H2,1-2H3
InChIKey FHVXKHJEURWJGC-UHFFFAOYSA-N
Mol Weight 429.37 g/mol
Molecular Formula C22H18Cl2N2OS
Exact Mass 428.05169 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9s9tG1lIfjE
Name 5-acetyl-2-[(2-chlorobenzyl)sulfanyl]-4-(2-chlorophenyl)-6-methyl-1,4-dihydro-3-pyridinecarbonitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.051689781 u
Formula C22H18Cl2N2OS
InChI InChI=1S/C22H18Cl2N2OS/c1-13-20(14(2)27)21(16-8-4-6-10-19(16)24)17(11-25)22(26-13)28-12-15-7-3-5-9-18(15)23/h3-10,21,26H,12H2,1-2H3
InChIKey FHVXKHJEURWJGC-UHFFFAOYSA-N
Molecular Weight 429.365 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1724
Solvent DMSO-d6
Source Vendor ID: NMR/12278307