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ethyl {[4-(4-chlorophenyl)-3-cyano-6-phenyl-2-pyridinyl]sulfanyl}acetate
SpectraBase Compound ID 4sl175EHvx7
InChI InChI=1S/C22H17ClN2O2S/c1-2-27-21(26)14-28-22-19(13-24)18(15-8-10-17(23)11-9-15)12-20(25-22)16-6-4-3-5-7-16/h3-12H,2,14H2,1H3
InChIKey XFWAHRHVYPGJPH-UHFFFAOYSA-N
Mol Weight 408.9 g/mol
Molecular Formula C22H17ClN2O2S
Exact Mass 408.069927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J6RTAeCa6JW
Name ethyl {[4-(4-chlorophenyl)-3-cyano-6-phenyl-2-pyridinyl]sulfanyl}acetate
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/C22H17ClN2O2S/c1-2-27-21(26)14-28-22-19(13-24)18(15-8-10-17(23)11-9-15)12-20(25-22)16-6-4-3-5-7-16/h3-12H,2,14H2,1H3
InChIKey XFWAHRHVYPGJPH-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20775
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: S18857; Labnumber: ULg1-225; SBI_ID: SBI-020779
Temperature 315 °C