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

*Links on SpectraBase are not permalinks.
3-pyridinecarbonitrile, 2-[[3-(4-chlorophenoxy)-2-hydroxypropyl]thio]-4-(4-methylphenyl)-6-phenyl-
SpectraBase Compound ID mKJWm86PQO
InChI InChI=1S/C28H23ClN2O2S/c1-19-7-9-20(10-8-19)25-15-27(21-5-3-2-4-6-21)31-28(26(25)16-30)34-18-23(32)17-33-24-13-11-22(29)12-14-24/h2-15,23,32H,17-18H2,1H3
InChIKey AIOZUOMVVFMUSD-UHFFFAOYSA-N
Mol Weight 487.02 g/mol
Molecular Formula C28H23ClN2O2S
Exact Mass 486.116877 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 IJUsMcD0Nm2
Name 3-pyridinecarbonitrile, 2-[[3-(4-chlorophenoxy)-2-hydroxypropyl]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/C28H23ClN2O2S/c1-19-7-9-20(10-8-19)25-15-27(21-5-3-2-4-6-21)31-28(26(25)16-30)34-18-23(32)17-33-24-13-11-22(29)12-14-24/h2-15,23,32H,17-18H2,1H3
InChIKey AIOZUOMVVFMUSD-UHFFFAOYSA-N
NMR Offset 15.8392
NMR Spectrometer Frequency 250.133
Observed nucleus 1H
Origin 1H_ASIOH_8516_6303
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/6020963; Labnumber: TSH-5206; IOH_ID: IOH-013306
Temperature 300 °C