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(3aR,9aR,9bS)-7,7-Dimethyl-1,3-dioxo-octahydrobenzo[e]isobenzofuran-9-yl acetate
SpectraBase Compound ID BkHq9kntl6A
InChI InChI=1S/C16H18O5/c1-8(17)20-11-7-16(2,3)6-9-4-5-10-13(12(9)11)15(19)21-14(10)18/h4,7,10,12-13H,5-6H2,1-3H3/t10-,12-,13-/m1/s1
InChIKey GNRWOMKYKMVVEH-RAIGVLPGSA-N
Mol Weight 290.31 g/mol
Molecular Formula C16H18O5
Exact Mass 290.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DU30Pr158M
Name (3aR,9aR,9bS)-7,7-Dimethyl-1,3-dioxo-octahydrobenzo[e]isobenzofuran-9-yl acetate
Alternate Name(s) (3aR,9aR,9bS)-7,7-dimethyl-1,3-dioxo-1,3,3a,4,6,7,9a,9b-octahydronaphtho[1,2-c]furan-9-yl acetate 7,7-Dimethyl-1,3-dioxo-octahydrobenzo[e]isobenzofuran-9-yl acetate
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Formula C16H18O5
InChI InChI=1S/C16H18O5/c1-8(17)20-11-7-16(2,3)6-9-4-5-10-13(12(9)11)15(19)21-14(10)18/h4,7,10,12-13H,5-6H2,1-3H3/t10-,12-,13-/m1/s1
InChIKey GNRWOMKYKMVVEH-RAIGVLPGSA-N
Molecular Weight 290.315 g/mol
SMILES C1(OC(=O)[C@]2([C@@]1([C@]1(C(=CC(CC1=CC2)(C)C)OC(=O)C)[H])[H])[H])=O
SPLASH splash10-001j-0090000000-c78698aaa51c6d90b75b
Source of Spectrum B-55-347-6
Wiley ID 1517073