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4-{5-[(E)-(1-(4-methoxyphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
SpectraBase Compound ID 3nlGgAX9yD5
InChI InChI=1S/C23H16N2O7/c1-31-16-8-6-15(7-9-16)25-21(27)18(20(26)24-23(25)30)12-17-10-11-19(32-17)13-2-4-14(5-3-13)22(28)29/h2-12H,1H3,(H,28,29)(H,24,26,30)/b18-12+
InChIKey CUGLMODKGGEERJ-LDADJPATSA-N
Mol Weight 432.39 g/mol
Molecular Formula C23H16N2O7
Exact Mass 432.095751 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7Br4F7kcB0t
Name 4-{5-[(E)-(1-(4-methoxyphenyl)-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/C23H16N2O7/c1-31-16-8-6-15(7-9-16)25-21(27)18(20(26)24-23(25)30)12-17-10-11-19(32-17)13-2-4-14(5-3-13)22(28)29/h2-12H,1H3,(H,28,29)(H,24,26,30)/b18-12+
InChIKey CUGLMODKGGEERJ-LDADJPATSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_2643
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: ZI/8139839; Labnumber: LD-120487