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2-{[5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chlorobenzyl)acetamide
SpectraBase Compound ID 6e6XDIhVweb
InChI InChI=1S/C18H16BrClN4OS/c1-24-17(13-4-6-14(19)7-5-13)22-23-18(24)26-11-16(25)21-10-12-2-8-15(20)9-3-12/h2-9H,10-11H2,1H3,(H,21,25)
InChIKey SVFNNSZFNPYGIF-UHFFFAOYSA-N
Mol Weight 451.77 g/mol
Molecular Formula C18H16BrClN4OS
Exact Mass 449.991673 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID hhJHFDIuwu
Name 2-{[5-(4-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chlorobenzyl)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/C18H16BrClN4OS/c1-24-17(13-4-6-14(19)7-5-13)22-23-18(24)26-11-16(25)21-10-12-2-8-15(20)9-3-12/h2-9H,10-11H2,1H3,(H,21,25)
InChIKey SVFNNSZFNPYGIF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6829
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: UZI/1265468; Labnumber: COL3560; UZI_ID: UZI-006831
Temperature 318 °C