4-Amino-2-(4-nitro-benzyl)-2,4-dihydro-[1,2,4]triazole-3-thione

SpectraBase Compound ID	HWRJGJ6SWjj
InChI	InChI=1S/C9H9N5O2S/c10-12-6-11-13(9(12)17)5-7-1-3-8(4-2-7)14(15)16/h1-4,6H,5,10H2
InChIKey	DCLUXEMUZYQZQE-UHFFFAOYSA-N Google Search
Mol Weight	251.26 g/mol
Molecular Formula	C9H9N5O2S
Exact Mass	251.047696 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	4KH1vY6AIeX
Name	3H-1,2,4-triazole-3-thione, 4-amino-2,4-dihydro-2-[(4-nitrophenyl)methyl]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	251.047695722 u
Formula	C9H9N5O2S
InChI	InChI=1S/C9H9N5O2S/c10-12-6-11-13(9(12)17)5-7-1-3-8(4-2-7)14(15)16/h1-4,6H,5,10H2
InChIKey	DCLUXEMUZYQZQE-UHFFFAOYSA-N
Molecular Weight	251.264 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_18418
Solvent	DMSO-d6
Source	Vendor ID: NMR/11280433; Lab Info: L-42.Shitov; Lab Number: L-42/1060001