(2E)-N-(tert-butyl)-3-phenyl-3-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]-2-propen-1-aminium chloride

SpectraBase Compound ID	83Ytdo4JGuC
InChI	InChI=1S/C20H23N5S.ClH/c1-20(2,3)21-15-14-18(16-10-6-4-7-11-16)26-19-22-23-24-25(19)17-12-8-5-9-13-17;/h4-14,21H,15H2,1-3H3;1H/b18-14+;
InChIKey	KXARLFCMCSJCTA-LSJACRKWSA-N Google Search
Mol Weight	401.96 g/mol
Molecular Formula	C20H24ClN5S
Exact Mass	401.144095 g/mol

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SpectraBase Spectrum ID	Bkbbz0LVJ8
Name	(2E)-N-(tert-butyl)-3-phenyl-3-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]-2-propen-1-aminium chloride
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/C20H23N5S.ClH/c1-20(2,3)21-15-14-18(16-10-6-4-7-11-16)26-19-22-23-24-25(19)17-12-8-5-9-13-17;/h4-14,21H,15H2,1-3H3;1H/b18-14+;
InChIKey	KXARLFCMCSJCTA-LSJACRKWSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_35279
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: E90728; SBI_ID: SBI-035283
Synonyms	N-(tert-butyl)-3-phenyl-3-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]-2-propen-1-aminium chloride
Temperature	308 °C