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N-(3-bromophenyl)-2-({5-[(2-naphthyloxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SpectraBase Compound ID LBJcoU2bvU5
InChI InChI=1S/C27H21BrN4O2S/c28-21-9-6-10-22(16-21)29-26(33)18-35-27-31-30-25(32(27)23-11-2-1-3-12-23)17-34-24-14-13-19-7-4-5-8-20(19)15-24/h1-16H,17-18H2,(H,29,33)
InChIKey IVKNOSOSZFVWHN-UHFFFAOYSA-N
Mol Weight 545.46 g/mol
Molecular Formula C27H21BrN4O2S
Exact Mass 544.05686 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LW6x4fY0iPD
Name N-(3-bromophenyl)-2-({5-[(2-naphthyloxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)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/C27H21BrN4O2S/c28-21-9-6-10-22(16-21)29-26(33)18-35-27-31-30-25(32(27)23-11-2-1-3-12-23)17-34-24-14-13-19-7-4-5-8-20(19)15-24/h1-16H,17-18H2,(H,29,33)
InChIKey IVKNOSOSZFVWHN-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4052
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/8114743; UBI_ID: UBI-004053
Temperature 308 °C