1H-1,2,4-triazole, 5-(dodecylthio)-1-[(4-methoxyphenyl)methyl]-3-nitro-

SpectraBase Compound ID	2Rp2quPOtMG
InChI	InChI=1S/C22H34N4O3S/c1-3-4-5-6-7-8-9-10-11-12-17-30-22-23-21(26(27)28)24-25(22)18-19-13-15-20(29-2)16-14-19/h13-16H,3-12,17-18H2,1-2H3
InChIKey	OUPKYNHMGDUNOE-UHFFFAOYSA-N Google Search
Mol Weight	434.6 g/mol
Molecular Formula	C22H34N4O3S
Exact Mass	434.235162 g/mol

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SpectraBase Spectrum ID	H9XiPNurf1V
Name	1H-1,2,4-triazole, 5-(dodecylthio)-1-[(4-methoxyphenyl)methyl]-3-nitro-
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/C22H34N4O3S/c1-3-4-5-6-7-8-9-10-11-12-17-30-22-23-21(26(27)28)24-25(22)18-19-13-15-20(29-2)16-14-19/h13-16H,3-12,17-18H2,1-2H3
InChIKey	OUPKYNHMGDUNOE-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_6890
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/10321400; Labnumber: LP-3103262