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2,4,6(1H,3H,5H)-pyrimidinetrione, 1-(2,5-dimethoxyphenyl)-5-(1H-indol-3-ylmethylene)-, (5E)-
SpectraBase Compound ID 53jxKpkoL27
InChI InChI=1S/C21H17N3O5/c1-28-13-7-8-18(29-2)17(10-13)24-20(26)15(19(25)23-21(24)27)9-12-11-22-16-6-4-3-5-14(12)16/h3-11,22H,1-2H3,(H,23,25,27)/b15-9+
InChIKey VQWOIUNRBXMAHI-OQLLNIDSSA-N
Mol Weight 391.38 g/mol
Molecular Formula C21H17N3O5
Exact Mass 391.116821 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JFKCDiXFrvr
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 1-(2,5-dimethoxyphenyl)-5-(1H-indol-3-ylmethylene)-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 391.116820654 u
Formula C21H17N3O5
InChI InChI=1S/C21H17N3O5/c1-28-13-7-8-18(29-2)17(10-13)24-20(26)15(19(25)23-21(24)27)9-12-11-22-16-6-4-3-5-14(12)16/h3-11,22H,1-2H3,(H,23,25,27)/b15-9+
InChIKey VQWOIUNRBXMAHI-OQLLNIDSSA-N
Molecular Weight 391.383 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15135
Solvent DMSO-d6
Source Vendor ID: NMR/10311240; Lab Info: LP; Lab Number: LP-1708054