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4H-1,2,4-triazole-3-thiol, 4-(1,3-benzodioxol-5-yl)-5-(2,4-difluorophenyl)-
SpectraBase Compound ID HIWOZXseXAl
InChI InChI=1S/C15H9F2N3O2S/c16-8-1-3-10(11(17)5-8)14-18-19-15(23)20(14)9-2-4-12-13(6-9)22-7-21-12/h1-6H,7H2,(H,19,23)
InChIKey VPAPMKBNSOXESZ-UHFFFAOYSA-N
Mol Weight 333.31 g/mol
Molecular Formula C15H9F2N3O2S
Exact Mass 333.038354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GqBuei7wb0S
Name 4H-1,2,4-triazole-3-thiol, 4-(1,3-benzodioxol-5-yl)-5-(2,4-difluorophenyl)-
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/C15H9F2N3O2S/c16-8-1-3-10(11(17)5-8)14-18-19-15(23)20(14)9-2-4-12-13(6-9)22-7-21-12/h1-6H,7H2,(H,19,23)
InChIKey VPAPMKBNSOXESZ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7031
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: F29201; Labnumber: NNOBK-8091