5-(4-Chloro-benzyl)-4-(2-methoxy-phenyl)-4H-[1,2,4]triazole-3-thiol

SpectraBase Compound ID	HpHvbISTG8N
InChI	InChI=1S/C16H14ClN3OS/c1-21-14-5-3-2-4-13(14)20-15(18-19-16(20)22)10-11-6-8-12(17)9-7-11/h2-9H,10H2,1H3,(H,19,22)
InChIKey	BLVYZOALRSIBNT-UHFFFAOYSA-N Google Search
Mol Weight	331.82 g/mol
Molecular Formula	C16H14ClN3OS
Exact Mass	331.054611 g/mol

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SpectraBase Spectrum ID	HpcyhIrQ87l
Name	5-(4-chlorobenzyl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
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/C16H14ClN3OS/c1-21-14-5-3-2-4-13(14)20-15(18-19-16(20)22)10-11-6-8-12(17)9-7-11/h2-9H,10H2,1H3,(H,19,22)
InChIKey	BLVYZOALRSIBNT-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_4852
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: NMR/10301677; Labnumber: OBK-0003658; IOH_ID: IOH-004853
Synonyms	5-(4-chlorobenzyl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide