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4-[((E)-{5-[(3,4-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID BkuLtLQRQHj
InChI InChI=1S/C15H10Cl2F2N4O2S/c16-11-4-3-8(5-12(11)17)24-7-10-2-1-9(25-10)6-20-23-14(13(18)19)21-22-15(23)26/h1-6,13H,7H2,(H,22,26)/b20-6+
InChIKey BHLHSIWTKJYZDX-CGOBSMCZSA-N
Mol Weight 419.23 g/mol
Molecular Formula C15H10Cl2F2N4O2S
Exact Mass 417.986958 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2B3nOVQy92R
Name 4-[((E)-{5-[(3,4-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
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/C15H10Cl2F2N4O2S/c16-11-4-3-8(5-12(11)17)24-7-10-2-1-9(25-10)6-20-23-14(13(18)19)21-22-15(23)26/h1-6,13H,7H2,(H,22,26)/b20-6+
InChIKey BHLHSIWTKJYZDX-CGOBSMCZSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_29818
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: 1285915; SBI_ID: SBI-029822
Synonyms 4-[((E)-{5-[(3,4-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-[({5-[(3,4-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
Temperature 318 °C