1,3-benzenediol, 4-[4-(4-chlorophenyl)-5-mercapto-4H-1,2,4-triazol-3-yl]-

SpectraBase Compound ID	OzCHQDCQAE
InChI	InChI=1S/C14H10ClN3O2S/c15-8-1-3-9(4-2-8)18-13(16-17-14(18)21)11-6-5-10(19)7-12(11)20/h1-7,19-20H,(H,17,21)
InChIKey	IXPQFNYRMBPQBL-UHFFFAOYSA-N Google Search
Mol Weight	319.77 g/mol
Molecular Formula	C14H10ClN3O2S
Exact Mass	319.018225 g/mol

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SpectraBase Spectrum ID	3Fb7icTu1Zl
Name	1,3-benzenediol, 4-[4-(4-chlorophenyl)-5-mercapto-4H-1,2,4-triazol-3-yl]-
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/C14H10ClN3O2S/c15-8-1-3-9(4-2-8)18-13(16-17-14(18)21)11-6-5-10(19)7-12(11)20/h1-7,19-20H,(H,17,21)
InChIKey	IXPQFNYRMBPQBL-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_339
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: F03945; Labnumber: NNOBK-8376
Temperature	308 °C