4-Allyl-5-[4-(1-methyl-1-phenyl-ethyl)-phenoxymethyl]-4H-[1,2,4]triazole-3-thiol

SpectraBase Compound ID	9737WULGcnk
InChI	InChI=1S/C21H23N3OS/c1-4-14-24-19(22-23-20(24)26)15-25-18-12-10-17(11-13-18)21(2,3)16-8-6-5-7-9-16/h4-13H,1,14-15H2,2-3H3,(H,23,26)
InChIKey	AECLCPPRRANGDB-UHFFFAOYSA-N Google Search
Mol Weight	365.5 g/mol
Molecular Formula	C21H23N3OS
Exact Mass	365.156184 g/mol

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SpectraBase Spectrum ID	2OOtJnw8pwA
Name	4H-1,2,4-triazole-3-thiol, 5-[[4-(1-methyl-1-phenylethyl)phenoxy]methyl]-4-(2-propenyl)-
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/C21H23N3OS/c1-4-14-24-19(22-23-20(24)26)15-25-18-12-10-17(11-13-18)21(2,3)16-8-6-5-7-9-16/h4-13H,1,14-15H2,2-3H3,(H,23,26)
InChIKey	AECLCPPRRANGDB-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_3732
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/17231754; Labnumber: c_bloc-379