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3-pyridinecarbonitrile, 5-[[(3-chlorophenyl)amino]methylene]-1,2,5,6-tetrahydro-4-methyl-1-[2-(4-morpholinyl)ethyl]-2,6-dioxo-, (5Z)-

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3-pyridinecarbonitrile, 5-[[(3-chlorophenyl)amino]methylene]-1,2,5,6-tetrahydro-4-methyl-1-[2-(4-morpholinyl)ethyl]-2,6-dioxo-, (5Z)-
SpectraBase Compound ID 97kK4BLQO1S
InChI InChI=1S/C20H21ClN4O3/c1-14-17(12-22)19(26)25(6-5-24-7-9-28-10-8-24)20(27)18(14)13-23-16-4-2-3-15(21)11-16/h2-4,11,13,23H,5-10H2,1H3/b18-13-
InChIKey KVSFNHJUZKLQNQ-AQTBWJFISA-N
Mol Weight 400.87 g/mol
Molecular Formula C20H21ClN4O3
Exact Mass 400.130218 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3jELviMshVx
Name 3-pyridinecarbonitrile, 5-[[(3-chlorophenyl)amino]methylene]-1,2,5,6-tetrahydro-4-methyl-1-[2-(4-morpholinyl)ethyl]-2,6-dioxo-, (5Z)-
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/C20H21ClN4O3/c1-14-17(12-22)19(26)25(6-5-24-7-9-28-10-8-24)20(27)18(14)13-23-16-4-2-3-15(21)11-16/h2-4,11,13,23H,5-10H2,1H3/b18-13-
InChIKey KVSFNHJUZKLQNQ-AQTBWJFISA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5391
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: F25199; Labnumber: ExLab-216203