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1,3-cyclohexanedione, 2-[[[2-(4-acetyl-1-piperazinyl)ethyl]amino]methylene]-5-(4-methylphenyl)-
SpectraBase Compound ID BdQ7sV37w1E
InChI InChI=1S/C22H29N3O3/c1-16-3-5-18(6-4-16)19-13-21(27)20(22(28)14-19)15-23-7-8-24-9-11-25(12-10-24)17(2)26/h3-6,15,19,23H,7-14H2,1-2H3/b20-15-
InChIKey PYZQOLMMSRRFAD-HKWRFOASSA-N
Mol Weight 383.49 g/mol
Molecular Formula C22H29N3O3
Exact Mass 383.220892 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DqVMOuJ9Dhw
Name 1,3-cyclohexanedione, 2-[[[2-(4-acetyl-1-piperazinyl)ethyl]amino]methylene]-5-(4-methylphenyl)-
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/C22H29N3O3/c1-16-3-5-18(6-4-16)19-13-21(27)20(22(28)14-19)15-23-7-8-24-9-11-25(12-10-24)17(2)26/h3-6,15,19,23H,7-14H2,1-2H3/b20-15-
InChIKey PYZQOLMMSRRFAD-HKWRFOASSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_169
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/11249876