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4-methyl-3-{5-[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
SpectraBase Compound ID BEXmzeSEn7B
InChI InChI=1S/C24H18N2O6/c1-13-3-7-16(8-4-13)26-22(28)19(21(27)25-24(26)31)12-17-9-10-20(32-17)18-11-15(23(29)30)6-5-14(18)2/h3-12H,1-2H3,(H,29,30)(H,25,27,31)/b19-12-
InChIKey VKLQENKPIXWDGP-UNOMPAQXSA-N
Mol Weight 430.42 g/mol
Molecular Formula C24H18N2O6
Exact Mass 430.116486 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JeFFJanTXCU
Name 4-methyl-3-{5-[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
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/C24H18N2O6/c1-13-3-7-16(8-4-13)26-22(28)19(21(27)25-24(26)31)12-17-9-10-20(32-17)18-11-15(23(29)30)6-5-14(18)2/h3-12H,1-2H3,(H,29,30)(H,25,27,31)/b19-12-
InChIKey VKLQENKPIXWDGP-UNOMPAQXSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3561
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: 113192; Labnumber: PAVL-218215; VK_ID: VK-003562
Synonyms 4-methyl-3-{5-[(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
Temperature 308 °C