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Ethyl (3a.alpha.,4.beta.,5a.beta.,9.alpha.,9a.alpha.,9b.alpha.)-1,2,3,3a,4,5,6,9,9a,9b-decahydro-8,9a-dimethyl-2,4,6-trioxo-1H-benz[e]inden-9-acetate - 2-(Ethylene acetal)-Derivative

View entire compound with spectra: 1 MS (GC)

Ethyl (3a.alpha.,4.beta.,5a.beta.,9.alpha.,9a.alpha.,9b.alpha.)-1,2,3,3a,4,5,6,9,9a,9b-decahydro-8,9a-dimethyl-2,4,6-trioxo-1H-benz[e]inden-9-acetate - 2-(Ethylene acetal)-Derivative
SpectraBase Compound ID KIvP7UcyrkA
InChI InChI=1S/C21H28O6/c1-4-25-19(24)9-14-12(2)7-18(23)15-8-17(22)13-10-21(26-5-6-27-21)11-16(13)20(14,15)3/h7,13-16H,4-6,8-11H2,1-3H3/t13-,14+,15-,16+,20-/m0/s1
InChIKey KATFFLDVPHKYAE-OYFMXXACSA-N
Mol Weight 376.45 g/mol
Molecular Formula C21H28O6
Exact Mass 376.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoIYQ5iwAmQ
Name Ethyl (3a.alpha.,4.beta.,5a.beta.,9.alpha.,9a.alpha.,9b.alpha.)-1,2,3,3a,4,5,6,9,9a,9b-decahydro-8,9a-dimethyl-2,4,6-trioxo-1H-benz[e]inden-9-acetate - 2-(Ethylene acetal)-Derivative
Alternate Name(s) Ethyl (3a.alpha.,5a.beta.,9.alpha.,9a.alpha.,9b.alpha.)-1,2,3,3a,4,5,6,9,9a,9b-decahydro-8,9a-dimethyl-2,4,6-trioxo-1H-benz[e]inden-9-acetate - 2-(Ethylene acetal)-Derivative Ethyl 2-((3aS,5aR,9R,9aS,9bR)-8,9a-dimethyl-4,6-dioxo-1,3,3a,4,5,5a,6,9,9a,9b-decahydrospiro[cyclopenta[a]naphthalene-2,2'-[1,3]dioxolan]-9-yl)acetate 2-[(3'aS,5'aR,9'R,9'aS,9'bR)-8',9'a-dimethyl-4',6'-dioxo-9'-spiro[1,3-dioxolane-2,2'-3,3a,5,5a,9,9b-hexahydro-1H-cyclopenta[a]naphthalene]yl]acetic acid ethyl ester Ethyl 2-[(3'aS,5'aR,9'R,9'aS,9'bR)-8',9'a-dimethyl-4',6'-dioxospiro[1,3-dioxolane-2,2'-3,3a,5,5a,9,9b-hexahydro-1H-cyclopenta[a]naphthalene]-9'-yl]acetate Ethyl 2-[(3'aS,5'aR,9'R,9'aS,9'bR)-8',9'a-dimethyl-4',6'-dioxo-spiro[1,3-dioxolane-2,2'-3,3a,5,5a,9,9b-hexahydro-1H-cyclopenta[a]naphthalene]-9'-yl]acetate Ethyl 2-[(3'aS,5'aR,9'R,9'aS,9'bR)-8',9'a-dimethyl-4',6'-bis(oxidanylidene)spiro[1,3-dioxolane-2,2'-3,3a,5,5a,9,9b-hexahydro-1H-cyclopenta[a]naphthalene]-9'-yl]ethanoate
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Formula C21H28O6
InChI InChI=1S/C21H28O6/c1-4-25-19(24)9-14-12(2)7-18(23)15-8-17(22)13-10-21(26-5-6-27-21)11-16(13)20(14,15)3/h7,13-16H,4-6,8-11H2,1-3H3/t13-,14+,15-,16+,20-/m0/s1
InChIKey KATFFLDVPHKYAE-OYFMXXACSA-N
Molecular Weight 376.449 g/mol
SMILES [C@@]12([C@](C(=O)C=C([C@]2(CC(=O)OCC)[H])C)(CC(=O)[C@@]2([C@]1(CC1(OCCO1)C2)[H])[H])[H])C
SPLASH splash10-002s-9513000000-436d60cd5b3c0704e681
Source of Spectrum F5-3-3583-32
Wiley ID 1732541