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DIETHYL-2-[2-(3-NITROPHENYL)-2-OXOETHYL]-PROPIONAMIDO-MALONATE
SpectraBase Compound ID EMT0uciSviI
InChI InChI=1S/C18H22N2O8/c1-4-15(22)19-18(16(23)27-5-2,17(24)28-6-3)11-14(21)12-8-7-9-13(10-12)20(25)26/h7-10H,4-6,11H2,1-3H3,(H,19,22)
InChIKey HWMHYUXRBFCARK-UHFFFAOYSA-N
Mol Weight 394.38 g/mol
Molecular Formula C18H22N2O8
Exact Mass 394.137616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CYQUgxtlcsz
Name DIETHYL-2-[2-(3-NITROPHENYL)-2-OXOETHYL]-PROPIONAMIDO-MALONATE
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22N2O8
InChI InChI=1S/C18H22N2O8/c1-4-15(22)19-18(16(23)27-5-2,17(24)28-6-3)11-14(21)12-8-7-9-13(10-12)20(25)26/h7-10H,4-6,11H2,1-3H3,(H,19,22)
InChIKey HWMHYUXRBFCARK-UHFFFAOYSA-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 394.381 g/mol
Sample ID 64140
Solvent CDCl3