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3-pyridinecarbonitrile, 4-(4-bromophenyl)-6-phenyl-2-[(phenylmethyl)thio]-
SpectraBase Compound ID LaFDi4mFOyj
InChI InChI=1S/C25H17BrN2S/c26-21-13-11-19(12-14-21)22-15-24(20-9-5-2-6-10-20)28-25(23(22)16-27)29-17-18-7-3-1-4-8-18/h1-15H,17H2
InChIKey YQVVUUCWJZTLKE-UHFFFAOYSA-N
Mol Weight 457.39 g/mol
Molecular Formula C25H17BrN2S
Exact Mass 456.029583 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DwF1VLYAqqk
Name 3-pyridinecarbonitrile, 4-(4-bromophenyl)-6-phenyl-2-[(phenylmethyl)thio]-
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/C25H17BrN2S/c26-21-13-11-19(12-14-21)22-15-24(20-9-5-2-6-10-20)28-25(23(22)16-27)29-17-18-7-3-1-4-8-18/h1-15H,17H2
InChIKey YQVVUUCWJZTLKE-UHFFFAOYSA-N
NMR Offset 15.2038
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_3352
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: AG-205/5059400; Labnumber: TSH-1100; IOH_ID: IOH-010355
Temperature 313 °C