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3-pyridinecarbonitrile, 2-[[(4-chlorophenyl)methyl]thio]-4-(4-fluorophenyl)-6-phenyl-
SpectraBase Compound ID DxIMYp8BMFb
InChI InChI=1S/C25H16ClFN2S/c26-20-10-6-17(7-11-20)16-30-25-23(15-28)22(18-8-12-21(27)13-9-18)14-24(29-25)19-4-2-1-3-5-19/h1-14H,16H2
InChIKey TVZGYDFNXIIQQR-UHFFFAOYSA-N
Mol Weight 430.93 g/mol
Molecular Formula C25H16ClFN2S
Exact Mass 430.070676 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DvGZYUVGmbz
Name 3-pyridinecarbonitrile, 2-[[(4-chlorophenyl)methyl]thio]-4-(4-fluorophenyl)-6-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/C25H16ClFN2S/c26-20-10-6-17(7-11-20)16-30-25-23(15-28)22(18-8-12-21(27)13-9-18)14-24(29-25)19-4-2-1-3-5-19/h1-14H,16H2
InChIKey TVZGYDFNXIIQQR-UHFFFAOYSA-N
NMR Offset 16.9154
NMR Spectrometer Frequency 200.133
Observed nucleus 1H
Origin 1H_ASIOH_8516_6553
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: TSH/5633013; IOH_ID: IOH-013557
Temperature 313 °C