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4-((5Z)-5-[4-(dimethylamino)benzylidene]-2,4,6-trioxotetrahydro-1(2H)-pyrimidinyl)benzoic acid
SpectraBase Compound ID APGUdbOWZjC
InChI InChI=1S/C20H17N3O5/c1-22(2)14-7-3-12(4-8-14)11-16-17(24)21-20(28)23(18(16)25)15-9-5-13(6-10-15)19(26)27/h3-11H,1-2H3,(H,26,27)(H,21,24,28)/b16-11-
InChIKey COLMXPPNIQTSDI-WJDWOHSUSA-N
Mol Weight 379.37 g/mol
Molecular Formula C20H17N3O5
Exact Mass 379.116821 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1JaHAyQkUnS
Name benzoic acid, 4-[(5Z)-5-[[4-(dimethylamino)phenyl]methylene]tetrahydro-2,4,6-trioxopyrimidinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.116820654 u
Formula C20H17N3O5
InChI InChI=1S/C20H17N3O5/c1-22(2)14-7-3-12(4-8-14)11-16-17(24)21-20(28)23(18(16)25)15-9-5-13(6-10-15)19(26)27/h3-11H,1-2H3,(H,26,27)(H,21,24,28)/b16-11-
InChIKey COLMXPPNIQTSDI-WJDWOHSUSA-N
Molecular Weight 379.372 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15015
Solvent DMSO-d6
Source Vendor ID: NMR/10321634; Lab Info: LP; Lab Number: LP-1704037