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3-[(E)-2-(3,4-dimethoxy-5-propan-2-ylphenyl)ethenyl]-3,4,4-trimethyl-6-oxo-1-cyclohexenecarboxylic acid methyl ester
SpectraBase Compound ID 87cTfMS82RB
InChI InChI=1S/C24H32O5/c1-15(2)17-11-16(12-20(27-6)21(17)28-7)9-10-24(5)13-18(22(26)29-8)19(25)14-23(24,3)4/h9-13,15H,14H2,1-8H3/b10-9+
InChIKey LYKNKDITEMCKLX-MDZDMXLPSA-N
Mol Weight 400.5 g/mol
Molecular Formula C24H32O5
Exact Mass 400.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Cl8QA5Zpg7
Name 3-[(E)-2-(3,4-dimethoxy-5-propan-2-ylphenyl)ethenyl]-3,4,4-trimethyl-6-oxo-1-cyclohexenecarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O5
InChI InChI=1S/C24H32O5/c1-15(2)17-11-16(12-20(27-6)21(17)28-7)9-10-24(5)13-18(22(26)29-8)19(25)14-23(24,3)4/h9-13,15H,14H2,1-8H3/b10-9+
InChIKey LYKNKDITEMCKLX-MDZDMXLPSA-N
Molecular Weight 400.515 g/mol
SMILES C1(=CC(\C=C\c2cc(C(C)C)c(c(c2)OC)OC)(C)C(CC1=O)(C)C)C(=O)OC
SPLASH splash10-0gb9-0009400000-680cdc191e99acc23235
Source of Spectrum HE-2005-420-19
Synonyms 3-[(E)-2-(3-isopropyl-4,5-dimethoxy-phenyl)vinyl]-6-keto-3,4,4-trimethyl-cyclohexene-1-carboxylic acid methyl ester Methyl 3-[(E)-2-(3,4-dimethoxy-5-propan-2-yl-phenyl)ethenyl]-3,4,4-trimethyl-6-oxidanylidene-cyclohexene-1-carboxylate Methyl 3-[(E)-2-(3,4-dimethoxy-5-propan-2-ylphenyl)ethenyl]-3,4,4-trimethyl-6-oxocyclohexene-1-carboxylate Methyl 3-[(E)-2-(3-isopropyl-4,5-dimethoxy-phenyl)vinyl]-3,4,4-trimethyl-6-oxo-cyclohexene-1-carboxylate
Wiley ID 1613660