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3-(ethylsulfanyl)-5-methyl-N-((E)-{5-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-furyl}methylidene)-4H-1,2,4-triazol-4-amine
SpectraBase Compound ID AeBpr2e1Gbg
InChI InChI=1S/C17H14F4N4O2S/c1-3-28-17-24-23-9(2)25(17)22-7-10-4-5-11(27-10)8-26-16-14(20)12(18)6-13(19)15(16)21/h4-7H,3,8H2,1-2H3/b22-7+
InChIKey WGZGBNORHFPKNJ-QPJQQBGISA-N
Mol Weight 414.38 g/mol
Molecular Formula C17H14F4N4O2S
Exact Mass 414.07736 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID In6ycR60N0u
Name 3-(ethylsulfanyl)-5-methyl-N-((E)-{5-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-furyl}methylidene)-4H-1,2,4-triazol-4-amine
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/C17H14F4N4O2S/c1-3-28-17-24-23-9(2)25(17)22-7-10-4-5-11(27-10)8-26-16-14(20)12(18)6-13(19)15(16)21/h4-7H,3,8H2,1-2H3/b22-7+
InChIKey WGZGBNORHFPKNJ-QPJQQBGISA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31203
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: 1740963; SBI_ID: SBI-031207
Synonyms N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]-N-((E)-{5-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-furyl}methylidene)amine3-(ethylsulfanyl)-5-methyl-N-({5-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-furyl}methylidene)-4H-1,2,4-triazol-4-amine
Temperature 308 °C