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1,3-benzenediol, 4-[5-mercapto-4-[4-(trifluoromethoxy)phenyl]-4H-1,2,4-triazol-3-yl]-
SpectraBase Compound ID FWvpIovy6mC
InChI InChI=1S/C15H10F3N3O3S/c16-15(17,18)24-10-4-1-8(2-5-10)21-13(19-20-14(21)25)11-6-3-9(22)7-12(11)23/h1-7,22-23H,(H,20,25)
InChIKey LRSDNAKKCLKEFH-UHFFFAOYSA-N
Mol Weight 369.32 g/mol
Molecular Formula C15H10F3N3O3S
Exact Mass 369.039497 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I5NPgPnkraa
Name 1,3-benzenediol, 4-[5-mercapto-4-[4-(trifluoromethoxy)phenyl]-4H-1,2,4-triazol-3-yl]-
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/C15H10F3N3O3S/c16-15(17,18)24-10-4-1-8(2-5-10)21-13(19-20-14(21)25)11-6-3-9(22)7-12(11)23/h1-7,22-23H,(H,20,25)
InChIKey LRSDNAKKCLKEFH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6981
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/18277198; Labnumber: OBK-8562