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DIMETHYL-3-[1'-(4''-ACETYLPHENYL)-2'-METHYLPROP-1'-ENYL]-CYCLOHEX-4-ENE-1,2-DICARBOXYLATE
SpectraBase Compound ID DrhE4bgKiVI
InChI InChI=1S/C22H26O5/c1-13(2)19(16-11-9-15(10-12-16)14(3)23)17-7-6-8-18(21(24)26-4)20(17)22(25)27-5/h6-7,9-12,17-18,20H,8H2,1-5H3/t17?,18-,20-/m1/s1
InChIKey QZUGEQDZGKTUDY-PGDXBAMXSA-N
Mol Weight 370.45 g/mol
Molecular Formula C22H26O5
Exact Mass 370.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FSkSWOmaQsb
Name DIMETHYL-3-[1'-(4''-ACETYLPHENYL)-2'-METHYLPROP-1'-ENYL]-CYCLOHEX-4-ENE-1,2-DICARBOXYLATE
Compound Number 8D-4-ME CO-C6H4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H26O5
InChI InChI=1S/C22H26O5/c1-13(2)19(16-11-9-15(10-12-16)14(3)23)17-7-6-8-18(21(24)26-4)20(17)22(25)27-5/h6-7,9-12,17-18,20H,8H2,1-5H3/t17?,18-,20-/m1/s1
InChIKey QZUGEQDZGKTUDY-PGDXBAMXSA-N
Literature Reference Author M.KNOKE,A.D.MEIJERE
Literature Reference Citation EUR.J.ORG.CHEM.,2259(2005)
Molecular Weight 370.445 g/mol
Sample ID 39289
Solvent CDCl3