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(5aS,9aS)-9,9-Dimethyl-2,3,4,5a,6,8,9,9a-octahydrodibenzo[b,d]furan-1,7-dione
SpectraBase Compound ID 6RPzJH7SYN8
InChI InChI=1S/C14H18O3/c1-14(2)7-8(15)6-11-13(14)12-9(16)4-3-5-10(12)17-11/h11,13H,3-7H2,1-2H3/t11-,13+/m0/s1
InChIKey ZEHGQCBCBDPHKJ-WCQYABFASA-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 HDMf2kFXbhq
Name (5aS,9aS)-9,9-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)7-8(15)6-11-13(14)12-9(16)4-3-5-10(12)17-11/h11,13H,3-7H2,1-2H3/t11-,13+/m0/s1
InChIKey ZEHGQCBCBDPHKJ-WCQYABFASA-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 230
SMILES [C@@]12([C@](OC3=C2C(=O)CCC3)([H])CC(CC1(C)C)=O)[H]
SPLASH splash10-05g0-2910000000-bc1473e157937a6fc885
Source of Spectrum QE-22-SM9-3h (DOI: 10.1002/chem.201505027)
Thin-Layer Chromatography 0.40 (hexanes/EtOAc, 1:2)
Wiley ID 1903652