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(5Z)-1-(4-ethoxyphenyl)-5-({[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]amino}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID Cw6nnIXVxWq
InChI InChI=1S/C26H28N4O7/c1-4-35-17-7-5-16(6-8-17)30-25(32)18(24(31)28-26(30)33)12-27-13-19-21-15(9-10-29(19)2)11-20-22(23(21)34-3)37-14-36-20/h5-8,11-12,19,27H,4,9-10,13-14H2,1-3H3,(H,28,31,33)/b18-12-
InChIKey GKQKZFRPUXBSMR-PDGQHHTCSA-N
Mol Weight 508.53 g/mol
Molecular Formula C26H28N4O7
Exact Mass 508.195799 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5YWqs1KWWeu
Name (5Z)-1-(4-ethoxyphenyl)-5-({[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]amino}methylene)-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/C26H28N4O7/c1-4-35-17-7-5-16(6-8-17)30-25(32)18(24(31)28-26(30)33)12-27-13-19-21-15(9-10-29(19)2)11-20-22(23(21)34-3)37-14-36-20/h5-8,11-12,19,27H,4,9-10,13-14H2,1-3H3,(H,28,31,33)/b18-12-
InChIKey GKQKZFRPUXBSMR-PDGQHHTCSA-N
NMR Offset 15.3512
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10623
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 135003; Labnumber: NC98SP32-1127; VK_ID: VK-010627
Synonyms 1-(4-ethoxyphenyl)-5-({[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]amino}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C