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4-({[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}methyl)-N-phenyl-1-piperazinecarboxamide
SpectraBase Compound ID FA0KlEHSlmY
InChI InChI=1S/C21H28N4O3/c1-21(2)12-18(26)17(19(27)13-21)14-22-15-24-8-10-25(11-9-24)20(28)23-16-6-4-3-5-7-16/h3-7,14,22H,8-13,15H2,1-2H3,(H,23,28)
InChIKey VBWMHQHNIJSKDF-UHFFFAOYSA-N
Mol Weight 384.48 g/mol
Molecular Formula C21H28N4O3
Exact Mass 384.216141 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CVHyNOQ6AEu
Name 4-({[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}methyl)-N-phenyl-1-piperazinecarboxamide
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/C21H28N4O3/c1-21(2)12-18(26)17(19(27)13-21)14-22-15-24-8-10-25(11-9-24)20(28)23-16-6-4-3-5-7-16/h3-7,14,22H,8-13,15H2,1-2H3,(H,23,28)
InChIKey VBWMHQHNIJSKDF-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1206
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: UZI/7106188; UBI_ID: UBI-001207
Temperature 313 °C