5-[(2,5-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	7u5iIWGY5X6
InChI	InChI=1S/C12H15N3OS/c1-8-4-5-9(2)10(6-8)16-7-11-13-14-12(17)15(11)3/h4-6H,7H2,1-3H3,(H,14,17)
InChIKey	UDTFVEHEDILPRA-UHFFFAOYSA-N Google Search
Mol Weight	249.33 g/mol
Molecular Formula	C12H15N3OS
Exact Mass	249.093583 g/mol

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SpectraBase Spectrum ID	KyI6vi3cXb3
Name	5-[(2,5-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol
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/C12H15N3OS/c1-8-4-5-9(2)10(6-8)16-7-11-13-14-12(17)15(11)3/h4-6H,7H2,1-3H3,(H,14,17)
InChIKey	UDTFVEHEDILPRA-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_6891
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: UZI/1265352; Labnumber: COL3657; UZI_ID: UZI-006893
Synonyms	5-[(2,5-dimethylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature	318 °C