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2-{[5-(1H-1,2,3-benzotriazol-1-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide
SpectraBase Compound ID FN74rg7D7v9
InChI InChI=1S/C23H19N7OS/c31-22(24-17-9-3-1-4-10-17)16-32-23-27-26-21(30(23)18-11-5-2-6-12-18)15-29-20-14-8-7-13-19(20)25-28-29/h1-14H,15-16H2,(H,24,31)
InChIKey WFXYZVOAUALMEZ-UHFFFAOYSA-N
Mol Weight 441.51 g/mol
Molecular Formula C23H19N7OS
Exact Mass 441.137179 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6jVFcnNivuW
Name 2-{[5-(1H-1,2,3-benzotriazol-1-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenylacetamide
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/C23H19N7OS/c31-22(24-17-9-3-1-4-10-17)16-32-23-27-26-21(30(23)18-11-5-2-6-12-18)15-29-20-14-8-7-13-19(20)25-28-29/h1-14H,15-16H2,(H,24,31)
InChIKey WFXYZVOAUALMEZ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2611
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/8063455; UBI_ID: UBI-002612
Temperature 308 °C