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1-piperazineacetamide, N-(4-chloro-2-methylphenyl)-4-[2-[[[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl]amino]ethyl]-

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1-piperazineacetamide, N-(4-chloro-2-methylphenyl)-4-[2-[[[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl]amino]ethyl]-
SpectraBase Compound ID GMI8xoRFcsh
InChI InChI=1S/C29H35ClN4O3/c1-20-3-5-22(6-4-20)23-16-27(35)25(28(36)17-23)18-31-9-10-33-11-13-34(14-12-33)19-29(37)32-26-8-7-24(30)15-21(26)2/h3-8,15,18,23,31H,9-14,16-17,19H2,1-2H3,(H,32,37)/b25-18-
InChIKey RKPUYMLEOAKYDO-BWAHOGKJSA-N
Mol Weight 523.1 g/mol
Molecular Formula C29H35ClN4O3
Exact Mass 522.239769 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5i5sWEwXZut
Name 1-piperazineacetamide, N-(4-chloro-2-methylphenyl)-4-[2-[[[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl]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/C29H35ClN4O3/c1-20-3-5-22(6-4-20)23-16-27(35)25(28(36)17-23)18-31-9-10-33-11-13-34(14-12-33)19-29(37)32-26-8-7-24(30)15-21(26)2/h3-8,15,18,23,31H,9-14,16-17,19H2,1-2H3,(H,32,37)/b25-18-
InChIKey RKPUYMLEOAKYDO-BWAHOGKJSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_204
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/11249950