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4-[((E)-{5-[(2-chloro-6-methylphenoxy)methyl]-2-furyl}methylidene)amino]-5-ethyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 8mBCJKZlf3D
InChI InChI=1S/C17H17ClN4O2S/c1-3-15-20-21-17(25)22(15)19-9-12-7-8-13(24-12)10-23-16-11(2)5-4-6-14(16)18/h4-9H,3,10H2,1-2H3,(H,21,25)/b19-9+
InChIKey OJHRCQGXCFTKAO-DJKKODMXSA-N
Mol Weight 376.86 g/mol
Molecular Formula C17H17ClN4O2S
Exact Mass 376.076075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5wpK9DwVLP9
Name 4-[((E)-{5-[(2-chloro-6-methylphenoxy)methyl]-2-furyl}methylidene)amino]-5-ethyl-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/C17H17ClN4O2S/c1-3-15-20-21-17(25)22(15)19-9-12-7-8-13(24-12)10-23-16-11(2)5-4-6-14(16)18/h4-9H,3,10H2,1-2H3,(H,21,25)/b19-9+
InChIKey OJHRCQGXCFTKAO-DJKKODMXSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31121
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: 1733602; SBI_ID: SBI-031125
Synonyms 4-[((E)-{5-[(2-chloro-6-methylphenoxy)methyl]-2-furyl}methylidene)amino]-5-ethyl-4H-1,2,4-triazol-3-yl hydrosulfide4-[({5-[(2-chloro-6-methylphenoxy)methyl]-2-furyl}methylidene)amino]-5-ethyl-4H-1,2,4-triazole-3-thiol
Temperature 308 °C