4-((E)-{[3-(butylsulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-yl]imino}methyl)-2-methoxyphenol

SpectraBase Compound ID	9VeOIRSEKcz
InChI	InChI=1S/C15H18N6O2S/c1-3-4-7-24-15-19-18-14-20(10-17-21(14)15)16-9-11-5-6-12(22)13(8-11)23-2/h5-6,8-10,22H,3-4,7H2,1-2H3/b16-9+
InChIKey	AERHDVFJNPRXNL-CXUHLZMHSA-N Google Search
Mol Weight	346.41 g/mol
Molecular Formula	C15H18N6O2S
Exact Mass	346.121195 g/mol

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SpectraBase Spectrum ID	2fBbDkof6vV
Name	4-((E)-{[3-(butylsulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-yl]imino}methyl)-2-methoxyphenol
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/C15H18N6O2S/c1-3-4-7-24-15-19-18-14-20(10-17-21(14)15)16-9-11-5-6-12(22)13(8-11)23-2/h5-6,8-10,22H,3-4,7H2,1-2H3/b16-9+
InChIKey	AERHDVFJNPRXNL-CXUHLZMHSA-N
NMR Offset	15.0036
NMR Spectrometer Frequency	250.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_2443
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: l-42/0001820; IOH_ID: IOH-002444
Synonyms	4-({[3-(butylsulfanyl)-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-yl]imino}methyl)-2-methoxyphenol
Temperature	297 °C