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(5aS,7S,9aS)-7-Hydroxy-3,4,5a,6,7,8,9,9a-octahydrodibenzo[b,d]furan-1(2H)-one
SpectraBase Compound ID 7yZR411cN5Z
InChI InChI=1S/C12H16O3/c13-7-4-5-8-11(6-7)15-10-3-1-2-9(14)12(8)10/h7-8,11,13H,1-6H2/t7-,8+,11-/m0/s1
InChIKey LZJSTHQLJCRXNJ-RNSXUZJQSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JcExtwKy5Xb
Name (5aS,7S,9aS)-7-Hydroxy-3,4,5a,6,7,8,9,9a-octahydrodibenzo[b,d]furan-1(2H)-one
Appearance Colorless oil
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Exact Mass 208.109944372 u
Formula C12H16O3
GC Column HP-5MS (15 m x 0.25 mm)
InChI InChI=1S/C12H16O3/c13-7-4-5-8-11(6-7)15-10-3-1-2-9(14)12(8)10/h7-8,11,13H,1-6H2/t7-,8+,11-/m0/s1
InChIKey LZJSTHQLJCRXNJ-RNSXUZJQSA-N
Instrument Name Hewlett Packard Model 6890 GC-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201505027
Molecular Weight 208.257 g/mol
Quality 308
SMILES O[C@]1(CC[C@@]2([C@](OC3=C2C(=O)CCC3)([H])C1)[H])[H]
SPLASH splash10-0a4r-3930000000-ae1effdeb3e4d5ad4934
Sample Comments Mixture of diastereomers (6:1)
Source of Spectrum QE-22-SM18-8 (DOI: 10.1002/chem.201505027)
Thin-Layer Chromatography 0.15 (hexane/EtOAc, 1:2)
Wiley ID 1903669