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2,4,6(1H,3H,5H)-pyrimidinetrione, 1-[2-(1-cyclohexen-1-yl)ethyl]-5-[[1-(phenylmethyl)-1H-indol-3-yl]methylene]-, (5E)-
SpectraBase Compound ID 9Mb29DqFX95
InChI InChI=1S/C28H27N3O3/c32-26-24(27(33)31(28(34)29-26)16-15-20-9-3-1-4-10-20)17-22-19-30(18-21-11-5-2-6-12-21)25-14-8-7-13-23(22)25/h2,5-9,11-14,17,19H,1,3-4,10,15-16,18H2,(H,29,32,34)/b24-17+
InChIKey NZBVGWSPSUNHCQ-JJIBRWJFSA-N
Mol Weight 453.54 g/mol
Molecular Formula C28H27N3O3
Exact Mass 453.205242 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1QuHPqfwKD
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 1-[2-(1-cyclohexen-1-yl)ethyl]-5-[[1-(phenylmethyl)-1H-indol-3-yl]methylene]-, (5E)-
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/C28H27N3O3/c32-26-24(27(33)31(28(34)29-26)16-15-20-9-3-1-4-10-20)17-22-19-30(18-21-11-5-2-6-12-21)25-14-8-7-13-23(22)25/h2,5-9,11-14,17,19H,1,3-4,10,15-16,18H2,(H,29,32,34)/b24-17+
InChIKey NZBVGWSPSUNHCQ-JJIBRWJFSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_8726
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/12259264