For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Cyclohexan-1-one-3.alpha.,5.beta.-diacetic acid, 2.alpha.-(5-hydroxy-2,4-dimethoxyphenyl)-, diethyl ester
SpectraBase Compound ID JTsujtnV0jn
InChI InChI=1S/C22H30O8/c1-5-29-20(25)9-13-7-14(10-21(26)30-6-2)22(17(24)8-13)15-11-16(23)19(28-4)12-18(15)27-3/h11-14,22-23H,5-10H2,1-4H3
InChIKey UTQHOFHGBLRFJR-UHFFFAOYSA-N
Mol Weight 422.47 g/mol
Molecular Formula C22H30O8
Exact Mass 422.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7pbd4rvaKEj
Name Cyclohexan-1-one-3.alpha.,5.beta.-diacetic acid, 2.alpha.-(5-hydroxy-2,4-dimethoxyphenyl)-, diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30O8
InChI InChI=1S/C22H30O8/c1-5-29-20(25)9-13-7-14(10-21(26)30-6-2)22(17(24)8-13)15-11-16(23)19(28-4)12-18(15)27-3/h11-14,22-23H,5-10H2,1-4H3
InChIKey UTQHOFHGBLRFJR-UHFFFAOYSA-N
Molecular Weight 422.474 g/mol
SMILES Oc1cc(c(OC)cc1OC)C1C(=O)CC(CC1CC(=O)OCC)CC(=O)OCC
SPLASH splash10-00xr-4963300000-3900eb528a136651ce56
Synonyms 2-[3-(2-ethoxy-2-keto-ethyl)-4-(5-hydroxy-2,4-dimethoxy-phenyl)-5-keto-cyclohexyl]acetic acid ethyl ester 2-[3-(2-ethoxy-2-oxoethyl)-4-(5-hydroxy-2,4-dimethoxyphenyl)-5-oxocyclohexyl]acetic acid ethyl ester Ethyl 2-[3-(2-ethoxy-2-oxo-ethyl)-4-(5-hydroxy-2,4-dimethoxy-phenyl)-5-oxo-cyclohexyl]acetate Ethyl 2-[4-(2,4-dimethoxy-5-oxidanyl-phenyl)-3-(2-ethoxy-2-oxidanylidene-ethyl)-5-oxidanylidene-cyclohexyl]ethanoate
Wiley ID 1478680