For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-{[5-[(4-tert-butylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
SpectraBase Compound ID BHOCjDHVLvo
InChI InChI=1S/C29H32N4O2S/c1-20-6-12-23(13-7-20)30-27(34)19-36-28-32-31-26(33(28)24-14-8-21(2)9-15-24)18-35-25-16-10-22(11-17-25)29(3,4)5/h6-17H,18-19H2,1-5H3,(H,30,34)
InChIKey ZDCVVLWEVVSNNY-UHFFFAOYSA-N
Mol Weight 500.7 g/mol
Molecular Formula C29H32N4O2S
Exact Mass 500.224597 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID K4e9zghdi8o
Name 2-{[5-[(4-tert-butylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-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/C29H32N4O2S/c1-20-6-12-23(13-7-20)30-27(34)19-36-28-32-31-26(33(28)24-14-8-21(2)9-15-24)18-35-25-16-10-22(11-17-25)29(3,4)5/h6-17H,18-19H2,1-5H3,(H,30,34)
InChIKey ZDCVVLWEVVSNNY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5440
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/11221572; Labnumber: 0514; IOH_ID: IOH-005441