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2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
SpectraBase Compound ID 8LaLqtvItK
InChI InChI=1S/C28H30N4OS/c1-19-10-9-11-20(2)25(19)29-24(33)18-34-27-31-30-26(32(27)23-12-7-6-8-13-23)21-14-16-22(17-15-21)28(3,4)5/h6-17H,18H2,1-5H3,(H,29,33)
InChIKey YFGZTYQMZCMZLM-UHFFFAOYSA-N
Mol Weight 470.64 g/mol
Molecular Formula C28H30N4OS
Exact Mass 470.214033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 72sVvXJcxT2
Name 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,6-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/C28H30N4OS/c1-19-10-9-11-20(2)25(19)29-24(33)18-34-27-31-30-26(32(27)23-12-7-6-8-13-23)21-14-16-22(17-15-21)28(3,4)5/h6-17H,18H2,1-5H3,(H,29,33)
InChIKey YFGZTYQMZCMZLM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4901
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: E08337; Labnumber: GRES-36940; SBI_ID: SBI-004903
Temperature 318 °C