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(5aS,9aS)-3,3-Dimethyl-2,3,4,5a,6,8,9,9a-octahydrodibenzo[b,d]furan-1,7-dione
SpectraBase Compound ID FwlcqyzsO8V
InChI InChI=1S/C14H18O3/c1-14(2)6-10(16)13-9-4-3-8(15)5-11(9)17-12(13)7-14/h9,11H,3-7H2,1-2H3/t9-,11+/m1/s1
InChIKey VSGDNKNEYIZWTI-KOLCDFICSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOH79s604tM
Name (5aS,9aS)-3,3-Dimethyl-2,3,4,5a,6,8,9,9a-octahydrodibenzo[b,d]furan-1,7-dione
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.125594437 u
Formula C14H18O3
GC Column HP-5MS (15 m x 0.25 mm)
InChI InChI=1S/C14H18O3/c1-14(2)6-10(16)13-9-4-3-8(15)5-11(9)17-12(13)7-14/h9,11H,3-7H2,1-2H3/t9-,11+/m1/s1
InChIKey VSGDNKNEYIZWTI-KOLCDFICSA-N
Instrument Name Hewlett Packard Model 6890 GC-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201505027
Molecular Weight 234.295 g/mol
Quality 283
SMILES [C@@]12([C@](OC3=C2C(=O)CC(C3)(C)C)([H])CC(CC1)=O)[H]
SPLASH splash10-0a59-1950000000-d9615ce77acee7d1f391
Source of Spectrum QE-22-SM12-3o (DOI: 10.1002/chem.201505027)
Thin-Layer Chromatography 0.34 (hexanes/EtOAc, 1:2)
Wiley ID 1903659