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2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
SpectraBase Compound ID GoKABq6qLdV
InChI InChI=1S/C28H30N4O2S/c1-5-32-26(20-11-13-21(14-12-20)28(2,3)4)30-31-27(32)35-19-25(33)29-22-15-17-24(18-16-22)34-23-9-7-6-8-10-23/h6-18H,5,19H2,1-4H3,(H,29,33)
InChIKey OKVXGXZFVVIIDK-UHFFFAOYSA-N
Mol Weight 486.63 g/mol
Molecular Formula C28H30N4O2S
Exact Mass 486.208947 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EjpUqAmXTlx
Name 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)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/C28H30N4O2S/c1-5-32-26(20-11-13-21(14-12-20)28(2,3)4)30-31-27(32)35-19-25(33)29-22-15-17-24(18-16-22)34-23-9-7-6-8-10-23/h6-18H,5,19H2,1-4H3,(H,29,33)
InChIKey OKVXGXZFVVIIDK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4087
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: D98539; Labnumber: GRES-22491; SBI_ID: SBI-004089
Temperature 318 °C