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2-{3'-(1'',1''-BISETHOXYCARBONYL-ETHYLAMINO)-PHENOXY]-2-METHYLMALONIC-ACID-DIETHYLESTER
SpectraBase Compound ID HngpTisnwFw
InChI InChI=1S/C22H31NO9/c1-7-28-17(24)21(5,18(25)29-8-2)23-15-12-11-13-16(14-15)32-22(6,19(26)30-9-3)20(27)31-10-4/h11-14,23H,7-10H2,1-6H3
InChIKey FFVOKUFBAURCCQ-UHFFFAOYSA-N
Mol Weight 453.49 g/mol
Molecular Formula C22H31NO9
Exact Mass 453.199882 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPLB2myQFHY
Name 2-{3'-(1'',1''-BISETHOXYCARBONYL-ETHYLAMINO)-PHENOXY]-2-METHYLMALONIC-ACID-DIETHYLESTER
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31NO9
InChI InChI=1S/C22H31NO9/c1-7-28-17(24)21(5,18(25)29-8-2)23-15-12-11-13-16(14-15)32-22(6,19(26)30-9-3)20(27)31-10-4/h11-14,23H,7-10H2,1-6H3
InChIKey FFVOKUFBAURCCQ-UHFFFAOYSA-N
Literature Reference Author D.KIKELJ,E.SUHADOLC,U.URLEB,U.ZBONTAR
Literature Reference Citation J.HETCYCL.CHEM.,30,597(1993)
Literature Reference DOI 10.1002/jhet.5570300303
Molecular Weight 453.489 g/mol
Solvent DMSO-D6
Source File Reference UWPB334