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4-[((E)-{5-[(2,6-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(2-furyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID ESYsyA7hoxv
InChI InChI=1S/C18H12Cl2N4O3S/c19-13-3-1-4-14(20)16(13)26-10-12-7-6-11(27-12)9-21-24-17(22-23-18(24)28)15-5-2-8-25-15/h1-9H,10H2,(H,23,28)/b21-9+
InChIKey WHJUXPWJZGURKU-ZVBGSRNCSA-N
Mol Weight 435.29 g/mol
Molecular Formula C18H12Cl2N4O3S
Exact Mass 434.000717 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4bNAOKJDkkv
Name 4-[((E)-{5-[(2,6-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(2-furyl)-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/C18H12Cl2N4O3S/c19-13-3-1-4-14(20)16(13)26-10-12-7-6-11(27-12)9-21-24-17(22-23-18(24)28)15-5-2-8-25-15/h1-9H,10H2,(H,23,28)/b21-9+
InChIKey WHJUXPWJZGURKU-ZVBGSRNCSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31093
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: 1731463; SBI_ID: SBI-031097
Synonyms 4-[((E)-{5-[(2,6-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(2-furyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-[({5-[(2,6-dichlorophenoxy)methyl]-2-furyl}methylidene)amino]-5-(2-furyl)-4H-1,2,4-triazole-3-thiol
Temperature 306 °C