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(4-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitrophenyl)(4-pyridinyl)methanone
SpectraBase Compound ID 57TaBiDZj5O
InChI InChI=1S/C26H16FN5O3S/c27-20-6-4-5-19(15-20)25-29-30-26(31(25)21-7-2-1-3-8-21)36-23-10-9-18(16-22(23)32(34)35)24(33)17-11-13-28-14-12-17/h1-16H
InChIKey IQWZFXSXDVBIIN-UHFFFAOYSA-N
Mol Weight 497.5 g/mol
Molecular Formula C26H16FN5O3S
Exact Mass 497.095789 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7gGSUJIemPA
Name (4-{[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitrophenyl)(4-pyridinyl)methanone
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/C26H16FN5O3S/c27-20-6-4-5-19(15-20)25-29-30-26(31(25)21-7-2-1-3-8-21)36-23-10-9-18(16-22(23)32(34)35)24(33)17-11-13-28-14-12-17/h1-16H
InChIKey IQWZFXSXDVBIIN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5190
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/11211630; Labnumber: LP-2110100; IOH_ID: IOH-005191