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Dimethyl-cis-2,6-diphenyl-4-oxocyclohexane-1,1-dicarboxylate
SpectraBase Compound ID AoP7RGwMEPq
InChI InChI=1S/C22H22O5/c1-26-20(24)22(21(25)27-2)18(15-9-5-3-6-10-15)13-17(23)14-19(22)16-11-7-4-8-12-16/h3-12,18-19H,13-14H2,1-2H3/t18-,19+
InChIKey FTUPPKXMEXHVCD-KDURUIRLSA-N
Mol Weight 366.41 g/mol
Molecular Formula C22H22O5
Exact Mass 366.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AbEtzc0wAGM
Name DIMETHYL-CIS-2,6-DIPHENYL-4-OXOCYCLOHEXANE-1,1-DICARBOXYLATE
CAS Registry Number 54105-33-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O5
InChI InChI=1S/C22H22O5/c1-26-20(24)22(21(25)27-2)18(15-9-5-3-6-10-15)13-17(23)14-19(22)16-11-7-4-8-12-16/h3-12,18-19H,13-14H2,1-2H3/t18-,19+
InChIKey FTUPPKXMEXHVCD-KDURUIRLSA-N
Literature Reference Author A.T.ROWLAND,J.A.HOHNECKER,K.F.MCDANIEL,D.S.MOORE
Literature Reference Citation J.ORG.CHEM.,47,301(1982)
Literature Reference DOI 10.1021/jo00341a024
Molecular Weight 366.414 g/mol
Solvent CDCl3
Source File Reference UNIW20069