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DIETHYL-2-[2-(3-METHOXYPHENYL)-2-OXOETHYL]-TRANS-CROTONAMIDO-MALONATE
SpectraBase Compound ID G3kQDFcqXBi
InChI InChI=1S/C20H25NO7/c1-5-9-17(23)21-20(18(24)27-6-2,19(25)28-7-3)13-16(22)14-10-8-11-15(12-14)26-4/h5,8-12H,6-7,13H2,1-4H3,(H,21,23)/b9-5+
InChIKey PBUMGDYOLRSLOF-WEVVVXLNSA-N
Mol Weight 391.42 g/mol
Molecular Formula C20H25NO7
Exact Mass 391.163102 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Hhycaewafn
Name DIETHYL-2-[2-(3-METHOXYPHENYL)-2-OXOETHYL]-TRANS-CROTONAMIDO-MALONATE
Compound Number 10F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H25NO7
InChI InChI=1S/C20H25NO7/c1-5-9-17(23)21-20(18(24)27-6-2,19(25)28-7-3)13-16(22)14-10-8-11-15(12-14)26-4/h5,8-12H,6-7,13H2,1-4H3,(H,21,23)/b9-5+
InChIKey PBUMGDYOLRSLOF-WEVVVXLNSA-N
Literature Reference Author E.CAMACHO,J.LEON,A.CARRION,A.ENTRENA,G.ESCAMES,H.KHALDY,D.AC UNA-CASTROVIEJO,M.A.
Literature Reference Citation J.MED.CHEM.,45,263(2002)
Literature Reference DOI 10.1021/jm010916w
Molecular Weight 391.421 g/mol
Sample ID 64137
Solvent CDCl3