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(+)-3,3'-([(1R,2R)-CYClOHEXAN-1,2-DIYL]-DINITRILOBIS-(CHLOROMETHANO))-3,3'-DIMETHYLBIS-[BUTANOIC-ACID]-DIMETHYLESTER
SpectraBase Compound ID Auye1OJ8vh9
InChI InChI=1S/C22H36Cl2N2O4/c1-7-29-17(27)13-21(3,4)19(23)25-15-11-9-10-12-16(15)26-20(24)22(5,6)14-18(28)30-8-2/h15-16H,7-14H2,1-6H3/b25-19-,26-20-/t15-,16-/m1/s1
InChIKey DDZFPANVCZPTRI-BPGFHYQQSA-N
Mol Weight 463.4 g/mol
Molecular Formula C22H36Cl2N2O4
Exact Mass 462.205213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJxEYb82mv
Name (+)-3,3'-([(1R,2R)-CYClOHEXAN-1,2-DIYL]-DINITRILOBIS-(CHLOROMETHANO))-3,3'-DIMETHYLBIS-[BUTANOIC-ACID]-DIMETHYLESTER
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36Cl2N2O4
InChI InChI=1S/C22H36Cl2N2O4/c1-7-29-17(27)13-21(3,4)19(23)25-15-11-9-10-12-16(15)26-20(24)22(5,6)14-18(28)30-8-2/h15-16H,7-14H2,1-6H3/b25-19-,26-20-/t15-,16-/m1/s1
InChIKey DDZFPANVCZPTRI-BPGFHYQQSA-N
Literature Reference Author R.HAERTER,C.WEYMUTH,R.SCHEFFOLD,P.ENGEL,A.LINDEN
Literature Reference Citation HELV.CHIM.ACTA,76,353(1993)
Literature Reference DOI 10.1002/hlca.19930760120
Molecular Weight 463.445 g/mol
Solvent CDCl3
Source File Reference UWCS15189