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(5aS,9aS)-8,8-Diallyl-2,3,4,5a,6,8,9,9a-octahydrodibenzo[b,d]furan-1,7-dione
SpectraBase Compound ID GLfJeOhbUSV
InChI InChI=1S/C18H22O3/c1-3-8-18(9-4-2)11-12-15(10-16(18)20)21-14-7-5-6-13(19)17(12)14/h3-4,12,15H,1-2,5-11H2/t12-,15+/m1/s1
InChIKey PSRVYJWIIKHWPQ-DOMZBBRYSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 785JGDe1eY1
Name (5aS,9aS)-8,8-Diallyl-2,3,4,5a,6,8,9,9a-octahydrodibenzo[b,d]furan-1,7-dione
Appearance Colorless liquid
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Exact Mass 286.156894565 u
Formula C18H22O3
GC Column HP-5MS (15 m x 0.25 mm)
InChI InChI=1S/C18H22O3/c1-3-8-18(9-4-2)11-12-15(10-16(18)20)21-14-7-5-6-13(19)17(12)14/h3-4,12,15H,1-2,5-11H2/t12-,15+/m1/s1
InChIKey PSRVYJWIIKHWPQ-DOMZBBRYSA-N
Instrument Name Hewlett Packard Model 6890 GC-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201505027
Quality 183
SMILES [C@@]12([C@](OC3=C2C(=O)CCC3)([H])CC(C(C1)(CC=C)CC=C)=O)[H]
SPLASH splash10-0ar5-9350000000-7837c1346e57b1e2822a
Source of Spectrum QE-22-SM10-3k (DOI: 10.1002/chem.201505027)
Thin-Layer Chromatography 0.65 (hexanes/EtOAc, 1:2)
Wiley ID 1903655