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2-[4-Hydroxy-.alpha.-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3-methoxybenzyl]-5,5-dimethyl-1,3-cyclohexanedione
SpectraBase Compound ID 7MCjuqkFFhf
InChI InChI=1S/C24H30O6/c1-23(2)9-15(26)21(16(27)10-23)20(13-6-7-14(25)19(8-13)30-5)22-17(28)11-24(3,4)12-18(22)29/h6-8,20-21,25,28H,9-12H2,1-5H3
InChIKey LOUBSQZNMGONGE-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C24H30O6
Exact Mass 414.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hvwYULnnD1
Name 2-[4-Hydroxy-.alpha.-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3-methoxybenzyl]-5,5-dimethyl-1,3-cyclohexanedione
CAS Registry Number 316134-38-0
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O6
InChI InChI=1S/C24H30O6/c1-23(2)9-15(26)21(16(27)10-23)20(13-6-7-14(25)19(8-13)30-5)22-17(28)11-24(3,4)12-18(22)29/h6-8,20-21,25,28H,9-12H2,1-5H3
InChIKey LOUBSQZNMGONGE-UHFFFAOYSA-N
Molecular Weight 414.498 g/mol
SMILES Oc1ccc(C(C2=C(CC(CC2=O)(C)C)O)C2C(CC(CC2=O)(C)C)=O)cc1OC
SPLASH splash10-0ac3-9420000000-b5ebb02c37b1eaa7785e
Synonyms 2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(4-hydroxy-3-methoxyphenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione 2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(4-hydroxy-3-methoxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione 2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(4-hydroxy-3-methoxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione 2-[(6-hydroxy-4,4-dimethyl-2-oxocyclohex-1(6)-enyl)(4-hydroxy-3-methoxyphenyl) methyl]-5,5-dimethylcyclohexane-1,3-dione 3-Hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(4-hydroxy-3-methoxyphenyl)methyl]-5,5-dimethyl-2-cyclohexen-1-one
Wiley ID 1468700