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DIETHYL-2-[2-(2-AMINO-5-METHOXYPHENYL)-2-OXOETHYL]-BUTYRAMIDO-MALONATE
SpectraBase Compound ID IGQYPUF7GBT
InChI InChI=1S/C20H28N2O7/c1-5-8-17(24)22-20(18(25)28-6-2,19(26)29-7-3)12-16(23)14-11-13(27-4)9-10-15(14)21/h9-11H,5-8,12,21H2,1-4H3,(H,22,24)
InChIKey HLMXUSNNOLYXIP-UHFFFAOYSA-N
Mol Weight 408.45 g/mol
Molecular Formula C20H28N2O7
Exact Mass 408.189651 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADpbdh3Tjgz
Name DIETHYL-2-[2-(2-AMINO-5-METHOXYPHENYL)-2-OXOETHYL]-BUTYRAMIDO-MALONATE
Compound Number 7C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28N2O7
InChI InChI=1S/C20H28N2O7/c1-5-8-17(24)22-20(18(25)28-6-2,19(26)29-7-3)12-16(23)14-11-13(27-4)9-10-15(14)21/h9-11H,5-8,12,21H2,1-4H3,(H,22,24)
InChIKey HLMXUSNNOLYXIP-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 408.452 g/mol
Sample ID 64131
Solvent CDCl3