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2-[5-(2-CARBOXYETHYL)-6-OXO-2-PHENYL-1,6-DIHYDRO-4-PYRIMIDINYL]-BENZOIC-ACID
SpectraBase Compound ID CQgZNGBk400
InChI InChI=1S/C20H16N2O5/c23-16(24)11-10-15-17(13-8-4-5-9-14(13)20(26)27)21-18(22-19(15)25)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,23,24)(H,26,27)(H,21,22,25)
InChIKey ZNWLGBKTXTUGGG-UHFFFAOYSA-N
Mol Weight 364.36 g/mol
Molecular Formula C20H16N2O5
Exact Mass 364.105922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 20AdvWFCNGJ
Name 2-[5-(2-CARBOXYETHYL)-6-OXO-2-PHENYL-1,6-DIHYDRO-4-PYRIMIDINYL]-BENZOIC-ACID
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16N2O5
InChI InChI=1S/C20H16N2O5/c23-16(24)11-10-15-17(13-8-4-5-9-14(13)20(26)27)21-18(22-19(15)25)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,23,24)(H,26,27)(H,21,22,25)
InChIKey ZNWLGBKTXTUGGG-UHFFFAOYSA-N
Literature Reference Author N.MULLER,R.GRANET,L.LEPAGE,P.KRAUSZ,J.P.KRAUSZ,J.P.LAVAL
Literature Reference Citation J.HETCYCL.CHEM.,38,1447(2001)
Literature Reference DOI 10.1002/jhet.5570380630
Molecular Weight 364.357 g/mol
Solvent DMSO-D6
Source File Reference UWLU21570