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1-(4-ethylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
SpectraBase Compound ID JDCt0uiygSI
InChI InChI=1S/C26H25N3O2S/c1-3-20-11-13-21(14-12-20)24(30)18-32-26-28-27-25(17-31-23-7-5-4-6-8-23)29(26)22-15-9-19(2)10-16-22/h4-16H,3,17-18H2,1-2H3
InChIKey JKVGPWAVIVIJTH-UHFFFAOYSA-N
Mol Weight 443.57 g/mol
Molecular Formula C26H25N3O2S
Exact Mass 443.166748 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2dXShaGLNLd
Name 1-(4-ethylphenyl)-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
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/C26H25N3O2S/c1-3-20-11-13-21(14-12-20)24(30)18-32-26-28-27-25(17-31-23-7-5-4-6-8-23)29(26)22-15-9-19(2)10-16-22/h4-16H,3,17-18H2,1-2H3
InChIKey JKVGPWAVIVIJTH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5459
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/11221602; Labnumber: 0544; IOH_ID: IOH-005460