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4H-1,2,4-triazole-3-thiol, 4-(5-chloro-2-methoxyphenyl)-5-cyclopropyl-

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 4-(5-chloro-2-methoxyphenyl)-5-cyclopropyl-
SpectraBase Compound ID KuZPe5Q3pqj
InChI InChI=1S/C12H12ClN3OS/c1-17-10-5-4-8(13)6-9(10)16-11(7-2-3-7)14-15-12(16)18/h4-7H,2-3H2,1H3,(H,15,18)
InChIKey GOBZELKVUTXIJY-UHFFFAOYSA-N
Mol Weight 281.76 g/mol
Molecular Formula C12H12ClN3OS
Exact Mass 281.038961 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID RlFC3JEXTv
Name 4H-1,2,4-triazole-3-thiol, 4-(5-chloro-2-methoxyphenyl)-5-cyclopropyl-
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/C12H12ClN3OS/c1-17-10-5-4-8(13)6-9(10)16-11(7-2-3-7)14-15-12(16)18/h4-7H,2-3H2,1H3,(H,15,18)
InChIKey GOBZELKVUTXIJY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6610
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: NMR/18277060; Labnumber: OBK-8485