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4H-1,2,4-triazole-3-thiol, 5-(2-furanyl)-4-[4-(trifluoromethoxy)phenyl]-
SpectraBase Compound ID Jepko02oIow
InChI InChI=1S/C13H8F3N3O2S/c14-13(15,16)21-9-5-3-8(4-6-9)19-11(17-18-12(19)22)10-2-1-7-20-10/h1-7H,(H,18,22)
InChIKey VHXGONJNRPYQNB-UHFFFAOYSA-N
Mol Weight 327.28 g/mol
Molecular Formula C13H8F3N3O2S
Exact Mass 327.028932 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1RFyH075kRF
Name 4H-1,2,4-triazole-3-thiol, 5-(2-furanyl)-4-[4-(trifluoromethoxy)phenyl]-
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/C13H8F3N3O2S/c14-13(15,16)21-9-5-3-8(4-6-9)19-11(17-18-12(19)22)10-2-1-7-20-10/h1-7H,(H,18,22)
InChIKey VHXGONJNRPYQNB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6979
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/18277196; Labnumber: OBK-8560