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DIETHYL-E-4-CYANO-5-CYANOMETHYL-2,6-BIS-(ETHOXYCARBONYL)-3-HEPTEN-DIOIC-ACID
SpectraBase Compound ID LH7UlAmmdeZ
InChI InChI=1S/C20H26N2O8/c1-5-27-17(23)15(18(24)28-6-2)11-13(12-22)14(9-10-21)16(19(25)29-7-3)20(26)30-8-4/h11,14-16H,5-9H2,1-4H3/b13-11+
InChIKey CPXCKRQIJSOZHB-ACCUITESSA-N
Mol Weight 422.43 g/mol
Molecular Formula C20H26N2O8
Exact Mass 422.168916 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASx1LB3d5xU
Name DIETHYL-E-4-CYANO-5-CYANOMETHYL-2,6-BIS-(ETHOXYCARBONYL)-3-HEPTEN-DIOIC-ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26N2O8
InChI InChI=1S/C20H26N2O8/c1-5-27-17(23)15(18(24)28-6-2)11-13(12-22)14(9-10-21)16(19(25)29-7-3)20(26)30-8-4/h11,14-16H,5-9H2,1-4H3/b13-11+
InChIKey CPXCKRQIJSOZHB-ACCUITESSA-N
Literature Reference Author P.STANETTY,M.KREMSLEHNER,H.VOELLENKLE
Literature Reference Citation MH.CHEM.,129,291(1998)
Literature Reference DOI 10.1007/s007060050050
Molecular Weight 422.435 g/mol
Solvent CDCl3
Source File Reference UWRU2075