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2-{[5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
SpectraBase Compound ID 80Ku8XxkMlp
InChI InChI=1S/C30H34N4O2S/c1-20-9-7-11-24(17-20)34-27(18-36-25-15-13-23(14-16-25)30(4,5)6)32-33-29(34)37-19-28(35)31-26-12-8-10-21(2)22(26)3/h7-17H,18-19H2,1-6H3,(H,31,35)
InChIKey RNZRHELXPRLRFS-UHFFFAOYSA-N
Mol Weight 514.7 g/mol
Molecular Formula C30H34N4O2S
Exact Mass 514.240248 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FGO3KaMJEAq
Name 2-{[5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
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/C30H34N4O2S/c1-20-9-7-11-24(17-20)34-27(18-36-25-15-13-23(14-16-25)30(4,5)6)32-33-29(34)37-19-28(35)31-26-12-8-10-21(2)22(26)3/h7-17H,18-19H2,1-6H3,(H,31,35)
InChIKey RNZRHELXPRLRFS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5639
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: NMR/11221609; Labnumber: 0551; IOH_ID: IOH-005640