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DIETHYL-2-[2-(3-METHOXYPHENYL)-2-OXOETHYL]-CYCLOHEXANECARBOXAMIDO-MALONATE
SpectraBase Compound ID HW0tobDOhoE
InChI InChI=1S/C23H31NO7/c1-4-30-21(27)23(22(28)31-5-2,24-20(26)16-10-7-6-8-11-16)15-19(25)17-12-9-13-18(14-17)29-3/h9,12-14,16H,4-8,10-11,15H2,1-3H3,(H,24,26)
InChIKey LUSVZWRCIIENDX-UHFFFAOYSA-N
Mol Weight 433.5 g/mol
Molecular Formula C23H31NO7
Exact Mass 433.210052 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LNPtbYcvJg8
Name DIETHYL-2-[2-(3-METHOXYPHENYL)-2-OXOETHYL]-CYCLOHEXANECARBOXAMIDO-MALONATE
Compound Number 10E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H31NO7
InChI InChI=1S/C23H31NO7/c1-4-30-21(27)23(22(28)31-5-2,24-20(26)16-10-7-6-8-11-16)15-19(25)17-12-9-13-18(14-17)29-3/h9,12-14,16H,4-8,10-11,15H2,1-3H3,(H,24,26)
InChIKey LUSVZWRCIIENDX-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 433.502 g/mol
Sample ID 64136
Solvent CDCl3