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1-piperazinecarboxamide, N-(3,4-dichlorophenyl)-4-[2-[(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)amino]ethyl]-
SpectraBase Compound ID EgGBC0smuPF
InChI InChI=1S/C21H28Cl2N4O2/c1-21(2)13-16(11-17(28)14-21)24-5-6-26-7-9-27(10-8-26)20(29)25-15-3-4-18(22)19(23)12-15/h3-4,11-12,24H,5-10,13-14H2,1-2H3,(H,25,29)
InChIKey HPFFTBLTHMVPMO-UHFFFAOYSA-N
Mol Weight 439.39 g/mol
Molecular Formula C21H28Cl2N4O2
Exact Mass 438.158932 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6fQRR3ZjlmE
Name 1-piperazinecarboxamide, N-(3,4-dichlorophenyl)-4-[2-[(5,5-dimethyl-3-oxo-1-cyclohexen-1-yl)amino]ethyl]-
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/C21H28Cl2N4O2/c1-21(2)13-16(11-17(28)14-21)24-5-6-26-7-9-27(10-8-26)20(29)25-15-3-4-18(22)19(23)12-15/h3-4,11-12,24H,5-10,13-14H2,1-2H3,(H,25,29)
InChIKey HPFFTBLTHMVPMO-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_163
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/11249858