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5-(3-chlorophenyl)-4-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazol-3-yl hydrosulfide
SpectraBase Compound ID LFv2LkObpqe
InChI InChI=1S/C16H10ClF3N4S/c17-13-3-1-2-11(8-13)14-22-23-15(25)24(14)21-9-10-4-6-12(7-5-10)16(18,19)20/h1-9H,(H,23,25)/b21-9+
InChIKey HTQPDTXPODCBRA-ZVBGSRNCSA-N
Mol Weight 382.79 g/mol
Molecular Formula C16H10ClF3N4S
Exact Mass 382.02668 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9xCBfV9bpHn
Name 5-(3-chlorophenyl)-4-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazol-3-yl hydrosulfide
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/C16H10ClF3N4S/c17-13-3-1-2-11(8-13)14-22-23-15(25)24(14)21-9-10-4-6-12(7-5-10)16(18,19)20/h1-9H,(H,23,25)/b21-9+
InChIKey HTQPDTXPODCBRA-ZVBGSRNCSA-N
NMR Offset 16.5281
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16568
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: D25029; Labnumber: GRES-03052; SBI_ID: SBI-016571
Synonyms 5-(3-chlorophenyl)-4-({(E)-[4-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol5-(3-chlorophenyl)-4-({[4-(trifluoromethyl)phenyl]methylidene}amino)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C