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(6E)-4-benzoyl-2-(3-pyridinyl)-5-thioxo-4,5-dihydro-6H-1,3,4-oxadiazin-6-one (4-nitrophenyl)hydrazone

View entire compound with spectra: 1 NMR

(6E)-4-benzoyl-2-(3-pyridinyl)-5-thioxo-4,5-dihydro-6H-1,3,4-oxadiazin-6-one (4-nitrophenyl)hydrazone
SpectraBase Compound ID 4RqfhgLZTox
InChI InChI=1S/C21H14N6O4S/c28-20(14-5-2-1-3-6-14)26-21(32)19(31-18(25-26)15-7-4-12-22-13-15)24-23-16-8-10-17(11-9-16)27(29)30/h1-13,23H/b24-19+
InChIKey ANNFMPWKTPQIMW-LYBHJNIJSA-N
Mol Weight 446.44 g/mol
Molecular Formula C21H14N6O4S
Exact Mass 446.079724 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B2psWsX50mf
Name (6E)-4-benzoyl-2-(3-pyridinyl)-5-thioxo-4,5-dihydro-6H-1,3,4-oxadiazin-6-one (4-nitrophenyl)hydrazone
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/C21H14N6O4S/c28-20(14-5-2-1-3-6-14)26-21(32)19(31-18(25-26)15-7-4-12-22-13-15)24-23-16-8-10-17(11-9-16)27(29)30/h1-13,23H/b24-19+
InChIKey ANNFMPWKTPQIMW-LYBHJNIJSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16644
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: 987/00004172; Labnumber: 987/00004172218850; VK_ID: VK-016649
Synonyms 4-benzoyl-2-(3-pyridinyl)-5-thioxo-4,5-dihydro-6H-1,3,4-oxadiazin-6-one (4-nitrophenyl)hydrazone
Temperature 318 °C