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(5E)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(4-ethoxyphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 8WaztG8MML
InChI InChI=1S/C25H29N3O4/c1-4-32-21-12-10-20(11-13-21)28-24(30)22(23(29)26-25(28)31)15-18-14-16(2)27(17(18)3)19-8-6-5-7-9-19/h10-15,19H,4-9H2,1-3H3,(H,26,29,31)/b22-15+
InChIKey SBTXAVVRANETQA-PXLXIMEGSA-N
Mol Weight 435.52 g/mol
Molecular Formula C25H29N3O4
Exact Mass 435.215806 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1WmcLRLXrx2
Name (5E)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(4-ethoxyphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C25H29N3O4/c1-4-32-21-12-10-20(11-13-21)28-24(30)22(23(29)26-25(28)31)15-18-14-16(2)27(17(18)3)19-8-6-5-7-9-19/h10-15,19H,4-9H2,1-3H3,(H,26,29,31)/b22-15+
InChIKey SBTXAVVRANETQA-PXLXIMEGSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9687
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: 133716; Labnumber: AREF2K-3234; VK_ID: VK-009691
Synonyms 5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-1-(4-ethoxyphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 315 °C