(2S,4S)-2-[3-keto-6-(3-methoxyphenyl)hexyl]-2,4-dimethyl-cyclopentane-1,3-quinone

SpectraBase Compound ID	3ohT8qTLKa
InChI	InChI=1S/C20H26O4/c1-14-12-18(22)20(2,19(14)23)11-10-16(21)8-4-6-15-7-5-9-17(13-15)24-3/h5,7,9,13-14H,4,6,8,10-12H2,1-3H3/t14-,20-/m0/s1
InChIKey	WTLYNEVUJMWKSM-XOBRGWDASA-N Google Search
Mol Weight	330.42 g/mol
Molecular Formula	C20H26O4
Exact Mass	330.183109 g/mol

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SpectraBase Spectrum ID	Cpjcx2gcEut
Name	(2S,4S)-2-[3-keto-6-(3-methoxyphenyl)hexyl]-2,4-dimethyl-cyclopentane-1,3-quinone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H26O4
InChI	InChI=1S/C20H26O4/c1-14-12-18(22)20(2,19(14)23)11-10-16(21)8-4-6-15-7-5-9-17(13-15)24-3/h5,7,9,13-14H,4,6,8,10-12H2,1-3H3/t14-,20-/m0/s1
InChIKey	WTLYNEVUJMWKSM-XOBRGWDASA-N
Molecular Weight	330.424 g/mol
SMILES	[C@@]1(C([C@@](C)(CC1=O)[H])=O)(CCC(=O)CCCc1cc(OC)ccc1)C
SPLASH	splash10-001i-0901000000-1d2f8c99c7f150dbf792
Source of Spectrum	QC-11-1121-10
Synonyms	(2R,4R)-(+)-2-(6-m-Methoxyphenyl-3-oxohexyl)-2,4-dimethylcyclopentan-1,3-dione (2R,4R)-2-[6-(3-methoxyphenyl)-3-oxohexyl]-2,4-dimethyl-1,3-cyclopentanedione (2S,4S)-(+)-2-(6-m-Methoxyphenyl-3-oxohexyl)-2,4-dimethylcyclopentan-1,3-dione (2S,4S)-2-[6-(3-methoxyphenyl)-3-oxidanylidene-hexyl]-2,4-dimethyl-cyclopentane-1,3-dione (2S,4S)-2-[6-(3-methoxyphenyl)-3-oxohexyl]-2,4-dimethylcyclopentane-1,3-dione (2S,4S)-2-[6-(3-methoxyphenyl)-3-oxo-hexyl]-2,4-dimethyl-cyclopentane-1,3-dione
Wiley ID	859695