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4H-1,2,4-triazole-3-thiol, 5-[(3,5-difluorophenyl)methyl]-4-(2,5-dimethoxyphenyl)-
SpectraBase Compound ID 8shF1ujQT5B
InChI InChI=1S/C17H15F2N3O2S/c1-23-13-3-4-15(24-2)14(9-13)22-16(20-21-17(22)25)7-10-5-11(18)8-12(19)6-10/h3-6,8-9H,7H2,1-2H3,(H,21,25)
InChIKey QMZVWXYEDBGJDC-UHFFFAOYSA-N
Mol Weight 363.38 g/mol
Molecular Formula C17H15F2N3O2S
Exact Mass 363.085304 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EqJLvAHVmcE
Name 4H-1,2,4-triazole-3-thiol, 5-[(3,5-difluorophenyl)methyl]-4-(2,5-dimethoxyphenyl)-
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/C17H15F2N3O2S/c1-23-13-3-4-15(24-2)14(9-13)22-16(20-21-17(22)25)7-10-5-11(18)8-12(19)6-10/h3-6,8-9H,7H2,1-2H3,(H,21,25)
InChIKey QMZVWXYEDBGJDC-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6995
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/18277216; Labnumber: OBK-8582