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4H-1,2,4-triazole, 3-[[(4-chlorophenyl)methyl]thio]-4-cyclopropyl-5-(2-furanyl)-
SpectraBase Compound ID CMk0uhoz3cL
InChI InChI=1S/C16H14ClN3OS/c17-12-5-3-11(4-6-12)10-22-16-19-18-15(14-2-1-9-21-14)20(16)13-7-8-13/h1-6,9,13H,7-8,10H2
InChIKey VPZHXQAJIYELTK-UHFFFAOYSA-N
Mol Weight 331.82 g/mol
Molecular Formula C16H14ClN3OS
Exact Mass 331.054611 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Abpz6WupSpv
Name 4H-1,2,4-triazole, 3-[[(4-chlorophenyl)methyl]thio]-4-cyclopropyl-5-(2-furanyl)-
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/C16H14ClN3OS/c17-12-5-3-11(4-6-12)10-22-16-19-18-15(14-2-1-9-21-14)20(16)13-7-8-13/h1-6,9,13H,7-8,10H2
InChIKey VPZHXQAJIYELTK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10197
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: F36799; Labnumber: YAKV-41748