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1-[(2E)-2,7-dimethylocta-2,6-dienyl]-4-keto-2-phenyl-cyclohex-2-ene-1-carboxylic acid ethyl ester
SpectraBase Compound ID LToZSaR3lnc
InChI InChI=1S/C25H32O3/c1-5-28-24(27)25(18-20(4)12-10-9-11-19(2)3)16-15-22(26)17-23(25)21-13-7-6-8-14-21/h6-8,11-14,17H,5,9-10,15-16,18H2,1-4H3/b20-12+
InChIKey GUTZXMLZQZUMQA-UDWIEESQSA-N
Mol Weight 380.5 g/mol
Molecular Formula C25H32O3
Exact Mass 380.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dq0hWphdz0X
Name 1-[(2E)-2,7-dimethylocta-2,6-dienyl]-4-keto-2-phenyl-cyclohex-2-ene-1-carboxylic acid ethyl ester
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Formula C25H32O3
InChI InChI=1S/C25H32O3/c1-5-28-24(27)25(18-20(4)12-10-9-11-19(2)3)16-15-22(26)17-23(25)21-13-7-6-8-14-21/h6-8,11-14,17H,5,9-10,15-16,18H2,1-4H3/b20-12+
InChIKey GUTZXMLZQZUMQA-UDWIEESQSA-N
Molecular Weight 380.528 g/mol
SMILES C1(=O)C=C(C(C\C(=C\CCC=C(C)C)C)(C(=O)OCC)CC1)c1ccccc1
SPLASH splash10-00kf-9851000000-2c525e2aa4b5c917d335
Synonyms 1-[(2E)-2,7-dimethylocta-2,6-dienyl]-4-oxo-2-phenyl-1-cyclohex-2-enecarboxylic acid ethyl ester 2-Cyclohexene-4-carboxylic acid, 1-oxo-4-[(E)-3,7-dimethyl-2,6-octadien-1-yl]-3-phenyl-, ethyl ester Ethyl 1-[(2E)-2,7-dimethyl-2,6-octadienyl]-4-oxo-2-phenyl-2-cyclohexene-1-carboxylate Ethyl 1-[(2E)-2,7-dimethylocta-2,6-dienyl]-4-oxidanylidene-2-phenyl-cyclohex-2-ene-1-carboxylate Ethyl 1-[(2E)-2,7-dimethylocta-2,6-dienyl]-4-oxo-2-phenyl-cyclohex-2-ene-1-carboxylate
Wiley ID 1490663