For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-pyridinecarbonitrile, 2-[[2-hydroxy-3-[(phenylmethyl)sulfinyl]propyl]thio]-4-(4-methylphenyl)-6-phenyl-
SpectraBase Compound ID 6MGllBMgvGx
InChI InChI=1S/C29H26N2O2S2/c1-21-12-14-23(15-13-21)26-16-28(24-10-6-3-7-11-24)31-29(27(26)17-30)34-18-25(32)20-35(33)19-22-8-4-2-5-9-22/h2-16,25,32H,18-20H2,1H3
InChIKey ADWABSFPIYSHMV-UHFFFAOYSA-N
Mol Weight 498.66 g/mol
Molecular Formula C29H26N2O2S2
Exact Mass 498.14357 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3iO4pHw5Ily
Name 3-pyridinecarbonitrile, 2-[[2-hydroxy-3-[(phenylmethyl)sulfinyl]propyl]thio]-4-(4-methylphenyl)-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/C29H26N2O2S2/c1-21-12-14-23(15-13-21)26-16-28(24-10-6-3-7-11-24)31-29(27(26)17-30)34-18-25(32)20-35(33)19-22-8-4-2-5-9-22/h2-16,25,32H,18-20H2,1H3
InChIKey ADWABSFPIYSHMV-UHFFFAOYSA-N
NMR Offset 15.8392
NMR Spectrometer Frequency 250.133
Observed nucleus 1H
Origin 1H_ASIOH_8516_6306
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: ZI/6021559; Labnumber: TSH-5194; IOH_ID: IOH-013309
Temperature 300 °C