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

*Links on SpectraBase are not permalinks.
3-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
SpectraBase Compound ID CwhGMpdwIIH
InChI InChI=1S/C24H22ClN3O2S/c1-17-4-3-5-18(14-17)16-31-24-27-26-23(15-30-22-10-6-19(25)7-11-22)28(24)20-8-12-21(29-2)13-9-20/h3-14H,15-16H2,1-2H3
InChIKey NBTJSHKQAJZMMT-UHFFFAOYSA-N
Mol Weight 451.97 g/mol
Molecular Formula C24H22ClN3O2S
Exact Mass 451.112126 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 C0TXzJi9l93
Name 3-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole
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/C24H22ClN3O2S/c1-17-4-3-5-18(14-17)16-31-24-27-26-23(15-30-22-10-6-19(25)7-11-22)28(24)20-8-12-21(29-2)13-9-20/h3-14H,15-16H2,1-2H3
InChIKey NBTJSHKQAJZMMT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11411
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: E06944; Labnumber: GRES-32232; SBI_ID: SBI-011414
Temperature 318 °C