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4H-1,2,4-triazole-3-thiol, 5-[(4-chlorophenyl)methyl]-4-(3-pyridinyl)-
SpectraBase Compound ID A8AoxR2Qwpa
InChI InChI=1S/C14H11ClN4S/c15-11-5-3-10(4-6-11)8-13-17-18-14(20)19(13)12-2-1-7-16-9-12/h1-7,9H,8H2,(H,18,20)
InChIKey FHGVYUQNOGEAEB-UHFFFAOYSA-N
Mol Weight 302.78 g/mol
Molecular Formula C14H11ClN4S
Exact Mass 302.039295 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID qTPb2A7LOi
Name 4H-1,2,4-triazole-3-thiol, 5-[(4-chlorophenyl)methyl]-4-(3-pyridinyl)-
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/C14H11ClN4S/c15-11-5-3-10(4-6-11)8-13-17-18-14(20)19(13)12-2-1-7-16-9-12/h1-7,9H,8H2,(H,18,20)
InChIKey FHGVYUQNOGEAEB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1798
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: F13024; Labnumber: NNOBK-9067