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4H-1,2,4-triazole-3-thiol, 4-cyclohexyl-5-phenyl-

View entire compound with spectra: 3 NMR

4H-1,2,4-triazole-3-thiol, 4-cyclohexyl-5-phenyl-
SpectraBase Compound ID 9XJ9xiVxnDc
InChI InChI=1S/C14H17N3S/c18-14-16-15-13(11-7-3-1-4-8-11)17(14)12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,16,18)
InChIKey VTLLUDFHDJESNU-UHFFFAOYSA-N
Mol Weight 259.37 g/mol
Molecular Formula C14H17N3S
Exact Mass 259.114319 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 61DXxg6eAk2
Name 4-cyclohexyl-5-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
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/C14H17N3S/c18-14-16-15-13(11-7-3-1-4-8-11)17(14)12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,16,18)
InChIKey VTLLUDFHDJESNU-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_56
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: ZI/8055650; Labnumber: LP-0800836; IOH_ID: IOH-000057
Temperature 303 °C