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5-(diethylamino)-2-((E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
SpectraBase Compound ID JPb06oDtKjv
InChI InChI=1S/C20H23N5OS/c1-4-24(5-2)17-10-9-16(18(26)12-17)13-21-25-19(22-23-20(25)27)15-8-6-7-14(3)11-15/h6-13,26H,4-5H2,1-3H3,(H,23,27)/b21-13+
InChIKey VIBNGUIZRNDSOG-FYJGNVAPSA-N
Mol Weight 381.5 g/mol
Molecular Formula C20H23N5OS
Exact Mass 381.162332 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4AxbL2sTf22
Name 5-(diethylamino)-2-((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/C20H23N5OS/c1-4-24(5-2)17-10-9-16(18(26)12-17)13-21-25-19(22-23-20(25)27)15-8-6-7-14(3)11-15/h6-13,26H,4-5H2,1-3H3,(H,23,27)/b21-13+
InChIKey VIBNGUIZRNDSOG-FYJGNVAPSA-N
NMR Offset 16.5281
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16579
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: D25074; Labnumber: GRES-03101; SBI_ID: SBI-016582
Synonyms 5-(diethylamino)-2-({[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
Temperature 308 °C