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DIMETHYL-3-[2'-METHYL-1'-(2''-METHYLPHENYL)-PROP-1'-ENYL]-CYCLOHEX-4-ENE-1,2-DICARBOXYLATE

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DIMETHYL-3-[2'-METHYL-1'-(2''-METHYLPHENYL)-PROP-1'-ENYL]-CYCLOHEX-4-ENE-1,2-DICARBOXYLATE
SpectraBase Compound ID 9yEt1pP68nE
InChI InChI=1S/C21H26O4/c1-13(2)18(15-10-7-6-9-14(15)3)16-11-8-12-17(20(22)24-4)19(16)21(23)25-5/h6-11,16-17,19H,12H2,1-5H3/t16?,17-,19-/m1/s1
InChIKey NMTKRGXAYLYCGA-DOGRWBMSSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 42GQ9liG1hA
Name DIMETHYL-3-[2'-METHYL-1'-(2''-METHYLPHENYL)-PROP-1'-ENYL]-CYCLOHEX-4-ENE-1,2-DICARBOXYLATE
Compound Number 8D-2-M E-C6H4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-13(2)18(15-10-7-6-9-14(15)3)16-11-8-12-17(20(22)24-4)19(16)21(23)25-5/h6-11,16-17,19H,12H2,1-5H3/t16?,17-,19-/m1/s1
InChIKey NMTKRGXAYLYCGA-DOGRWBMSSA-N
Literature Reference Author M.KNOKE,A.D.MEIJERE
Literature Reference Citation EUR.J.ORG.CHEM.,2259(2005)
Molecular Weight 342.435 g/mol
Sample ID 39287
Solvent CDCl3