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(2E)-3-(1,3-benzodioxol-5-yl)-N-{3-[4-(3-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}propyl)-1-piperazinyl]propyl}-2-propenamide
SpectraBase Compound ID 24gDjh0Bn4D
InChI InChI=1S/C30H36N4O6/c35-29(9-5-23-3-7-25-27(19-23)39-21-37-25)31-11-1-13-33-15-17-34(18-16-33)14-2-12-32-30(36)10-6-24-4-8-26-28(20-24)40-22-38-26/h3-10,19-20H,1-2,11-18,21-22H2,(H,31,35)(H,32,36)/b9-5+,10-6+
InChIKey YYIMYRBMCMXOQK-NXZHAISVSA-N
Mol Weight 548.6 g/mol
Molecular Formula C30H36N4O6
Exact Mass 548.263485 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5InUiJxO6Jl
Name (2E)-3-(1,3-benzodioxol-5-yl)-N-{3-[4-(3-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}propyl)-1-piperazinyl]propyl}-2-propenamide
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/C30H36N4O6/c35-29(9-5-23-3-7-25-27(19-23)39-21-37-25)31-11-1-13-33-15-17-34(18-16-33)14-2-12-32-30(36)10-6-24-4-8-26-28(20-24)40-22-38-26/h3-10,19-20H,1-2,11-18,21-22H2,(H,31,35)(H,32,36)/b9-5+,10-6+
InChIKey YYIMYRBMCMXOQK-NXZHAISVSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16835
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/8185992; UBI_ID: UBI-016838
Synonyms 3-(1,3-benzodioxol-5-yl)-N-{3-[4-(3-{[3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}propyl)-1-piperazinyl]propyl}-2-propenamide
Temperature 318 °C