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2-ethoxy-6-((E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
SpectraBase Compound ID 6ulBHXTGBq3
InChI InChI=1S/C18H18N4O2S/c1-3-24-15-9-5-8-14(16(15)23)11-19-22-17(20-21-18(22)25)13-7-4-6-12(2)10-13/h4-11,23H,3H2,1-2H3,(H,21,25)/b19-11+
InChIKey ICLYUUYOTAUSLA-YBFXNURJSA-N
Mol Weight 354.43 g/mol
Molecular Formula C18H18N4O2S
Exact Mass 354.115047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IeJAlmKzhGH
Name 2-ethoxy-6-((E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
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/C18H18N4O2S/c1-3-24-15-9-5-8-14(16(15)23)11-19-22-17(20-21-18(22)25)13-7-4-6-12(2)10-13/h4-11,23H,3H2,1-2H3,(H,21,25)/b19-11+
InChIKey ICLYUUYOTAUSLA-YBFXNURJSA-N
NMR Offset 16.5281
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16570
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: D25045; Labnumber: GRES-03070; SBI_ID: SBI-016573
Synonyms 2-ethoxy-6-({[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
Temperature 308 °C