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

*Links on SpectraBase are not permalinks.
3-pyridinecarbonitrile, 2-[[2-hydroxy-3-[(4-methoxyphenyl)thio]propyl]thio]-4-(4-methylphenyl)-6-phenyl-
SpectraBase Compound ID I3TYhR3i7Jd
InChI InChI=1S/C29H26N2O2S2/c1-20-8-10-21(11-9-20)26-16-28(22-6-4-3-5-7-22)31-29(27(26)17-30)35-19-23(32)18-34-25-14-12-24(33-2)13-15-25/h3-16,23,32H,18-19H2,1-2H3
InChIKey DNLAQSVWJGNTEG-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 9S6ufIiWV5e
Name 3-pyridinecarbonitrile, 2-[[2-hydroxy-3-[(4-methoxyphenyl)thio]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/c1-20-8-10-21(11-9-20)26-16-28(22-6-4-3-5-7-22)31-29(27(26)17-30)35-19-23(32)18-34-25-14-12-24(33-2)13-15-25/h3-16,23,32H,18-19H2,1-2H3
InChIKey DNLAQSVWJGNTEG-UHFFFAOYSA-N
NMR Offset 15.8392
NMR Spectrometer Frequency 250.133
Observed nucleus 1H
Origin 1H_ASIOH_8516_6301
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/6020661; Labnumber: TSH-5198; IOH_ID: IOH-013304
Temperature 300 °C