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4H-1,2,4-triazole-3-thiol, 5-(2,3-difluorophenyl)-4-methyl-

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 5-(2,3-difluorophenyl)-4-methyl-
SpectraBase Compound ID IML2KNS4hbn
InChI InChI=1S/C9H7F2N3S/c1-14-8(12-13-9(14)15)5-3-2-4-6(10)7(5)11/h2-4H,1H3,(H,13,15)
InChIKey MDNRJKFZFQQVAI-UHFFFAOYSA-N
Mol Weight 227.23 g/mol
Molecular Formula C9H7F2N3S
Exact Mass 227.032875 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4blZxxSHGLR
Name 4H-1,2,4-triazole-3-thiol, 5-(2,3-difluorophenyl)-4-methyl-
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/C9H7F2N3S/c1-14-8(12-13-9(14)15)5-3-2-4-6(10)7(5)11/h2-4H,1H3,(H,13,15)
InChIKey MDNRJKFZFQQVAI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6622
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/18277072; Labnumber: OBK-8497