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1-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-methyl-4-oxo-1-cyclohex-2-enecarboxylic acid ethyl ester
SpectraBase Compound ID swZQ3HrNJh
InChI InChI=1S/C20H30O3/c1-6-23-19(22)20(13-11-18(21)14-17(20)5)12-10-16(4)9-7-8-15(2)3/h8,10,14H,6-7,9,11-13H2,1-5H3/b16-10+
InChIKey VNMYXSABFRPRAN-MHWRWJLKSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ij0d1PSZk
Name 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-methyl-4-oxo-1-cyclohex-2-enecarboxylic acid ethyl ester
Alternate Name(s) 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-4-keto-2-methyl-cyclohex-2-ene-1-carboxylic acid ethyl ester 2-Cyclohexen-1-one-4-carboxylic acid, 4-(3,7-dimethyl-2,6-octadien-1-yl)-3-methyl-, ethyl ester, (E)- Ethyl 1-[(2E)-3,7-dimethyl-2,6-octadienyl]-2-methyl-4-oxo-2-cyclohexene-1-carboxylate Ethyl 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-methyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Ethyl 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-2-methyl-4-oxo-cyclohex-2-ene-1-carboxylate
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Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-6-23-19(22)20(13-11-18(21)14-17(20)5)12-10-16(4)9-7-8-15(2)3/h8,10,14H,6-7,9,11-13H2,1-5H3/b16-10+
InChIKey VNMYXSABFRPRAN-MHWRWJLKSA-N
Molecular Weight 318.457 g/mol
SMILES CC(C)=CCC\C(C)=C\CC1(CCC(C=C1C)=O)C(=O)OCC
SPLASH splash10-00lr-9700000000-e73d370f40e4a0bf2dd6
Wiley ID 1491737