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

*Links on SpectraBase are not permalinks.

4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl 2,6-dichlorobenzyl sulfide

View entire compound with spectra: 1 NMR

4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl 2,6-dichlorobenzyl sulfide
SpectraBase Compound ID LZTeXgUEvYi
InChI InChI=1S/C18H14Cl3N3S/c1-2-10-24-17(12-6-3-4-7-14(12)19)22-23-18(24)25-11-13-15(20)8-5-9-16(13)21/h2-9H,1,10-11H2
InChIKey XTSJMQOVWDDCMA-UHFFFAOYSA-N
Mol Weight 410.75 g/mol
Molecular Formula C18H14Cl3N3S
Exact Mass 408.997402 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 K9lBMyxJ2o5
Name 4-allyl-5-(2-chlorophenyl)-4H-1,2,4-triazol-3-yl 2,6-dichlorobenzyl sulfide
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/C18H14Cl3N3S/c1-2-10-24-17(12-6-3-4-7-14(12)19)22-23-18(24)25-11-13-15(20)8-5-9-16(13)21/h2-9H,1,10-11H2
InChIKey XTSJMQOVWDDCMA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14535
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: D98661; Labnumber: GRES-24483; SBI_ID: SBI-014538
Synonyms 4-allyl-3-(2-chlorophenyl)-5-[(2,6-dichlorobenzyl)sulfanyl]-4H-1,2,4-triazole
Temperature 308 °C