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

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 5-(5-chloro-2-methoxyphenyl)-4-cyclopropyl-
SpectraBase Compound ID DpOPbtZhB4B
InChI InChI=1S/C12H12ClN3OS/c1-17-10-5-2-7(13)6-9(10)11-14-15-12(18)16(11)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H,15,18)
InChIKey MQWRXMHNFVHNJO-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 EKBGDSTeUGh
Name 4H-1,2,4-triazole-3-thiol, 5-(5-chloro-2-methoxyphenyl)-4-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/c1-17-10-5-2-7(13)6-9(10)11-14-15-12(18)16(11)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H,15,18)
InChIKey MQWRXMHNFVHNJO-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8133
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: F31571; Labnumber: SPYEL-7194