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2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
SpectraBase Compound ID GoOq4epITh8
InChI InChI=1S/C21H24N4O2S/c1-4-25-19(13-27-18-10-8-15(2)9-11-18)23-24-21(25)28-14-20(26)22-17-7-5-6-16(3)12-17/h5-12H,4,13-14H2,1-3H3,(H,22,26)
InChIKey OXDGYFUEZYLSOQ-UHFFFAOYSA-N
Mol Weight 396.51 g/mol
Molecular Formula C21H24N4O2S
Exact Mass 396.161997 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8WPblFOHazF
Name 2-({4-ethyl-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)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/C21H24N4O2S/c1-4-25-19(13-27-18-10-8-15(2)9-11-18)23-24-21(25)28-14-20(26)22-17-7-5-6-16(3)12-17/h5-12H,4,13-14H2,1-3H3,(H,22,26)
InChIKey OXDGYFUEZYLSOQ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11172
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: E06187; Labnumber: GRES-17774; SBI_ID: SBI-011175
Temperature 306 °C