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2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(3-nitrophenyl)ethanone

View entire compound with spectra: 1 NMR

2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(3-nitrophenyl)ethanone
SpectraBase Compound ID Ea3ZreXiHHD
InChI InChI=1S/C22H16N4O3S/c27-20(17-10-7-13-19(14-17)26(28)29)15-30-22-24-23-21(16-8-3-1-4-9-16)25(22)18-11-5-2-6-12-18/h1-14H,15H2
InChIKey XNODDKLNTDQISD-UHFFFAOYSA-N
Mol Weight 416.46 g/mol
Molecular Formula C22H16N4O3S
Exact Mass 416.094312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HoaFemyGv1J
Name 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(3-nitrophenyl)ethanone
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/C22H16N4O3S/c27-20(17-10-7-13-19(14-17)26(28)29)15-30-22-24-23-21(16-8-3-1-4-9-16)25(22)18-11-5-2-6-12-18/h1-14H,15H2
InChIKey XNODDKLNTDQISD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5898
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: 121796; Labnumber: EX00112131; VK_ID: VK-005901
Temperature 318 °C