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DIMETHYL-2-[1',2'-DI-(4-CHLOROBENZOYL)-ETHYL]-MALONATE
SpectraBase Compound ID 8scKaNv7Su
InChI InChI=1S/C21H18Cl2O6/c1-28-20(26)18(21(27)29-2)16(19(25)13-5-9-15(23)10-6-13)11-17(24)12-3-7-14(22)8-4-12/h3-10,16,18H,11H2,1-2H3
InChIKey ZODKGCCWEBEOLT-UHFFFAOYSA-N
Mol Weight 437.28 g/mol
Molecular Formula C21H18Cl2O6
Exact Mass 436.048044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5nYfwIkYfe3
Name DIMETHYL-2-[1',2'-DI-(4-CHLOROBENZOYL)-ETHYL]-MALONATE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18Cl2O6
InChI InChI=1S/C21H18Cl2O6/c1-28-20(26)18(21(27)29-2)16(19(25)13-5-9-15(23)10-6-13)11-17(24)12-3-7-14(22)8-4-12/h3-10,16,18H,11H2,1-2H3
InChIKey ZODKGCCWEBEOLT-UHFFFAOYSA-N
Literature Reference Author A.PADMAJA,G.S.REDDY,A.V.N.MOHAN,V.PADMAVATHI
Literature Reference Citation CHEM.PHARM.BULL.,56,647(2008)
Literature Reference DOI 10.1248/cpb.56.647
Molecular Weight 437.276 g/mol
Sample ID 1569
Solvent DMSO-D6