3-(4-tert-butylphenyl)-4-ethyl-5-[(4-methylbenzyl)sulfanyl]-4H-1,2,4-triazole

SpectraBase Compound ID	GF8yxRkT8qe
InChI	InChI=1S/C22H27N3S/c1-6-25-20(18-11-13-19(14-12-18)22(3,4)5)23-24-21(25)26-15-17-9-7-16(2)8-10-17/h7-14H,6,15H2,1-5H3
InChIKey	YCOHUVNVNLQAMY-UHFFFAOYSA-N Google Search
Mol Weight	365.54 g/mol
Molecular Formula	C22H27N3S
Exact Mass	365.192569 g/mol

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SpectraBase Spectrum ID	4JYTnnlLhOX
Name	3-(4-tert-butylphenyl)-4-ethyl-5-[(4-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/C22H27N3S/c1-6-25-20(18-11-13-19(14-12-18)22(3,4)5)23-24-21(25)26-15-17-9-7-16(2)8-10-17/h7-14H,6,15H2,1-5H3
InChIKey	YCOHUVNVNLQAMY-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11740
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: E08687; Labnumber: GRES-37351; SBI_ID: SBI-011743
Synonyms	5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl 4-methylbenzyl sulfide
Temperature	308 °C