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(2R,4aR,9bR)-tert-Butyl 2-(3,9-dioxo-1,2,3,4,4a,6,7,8,9,9b-decahydrodibenzo[b,d]furan-2-yl)acetate
SpectraBase Compound ID HYIEqMFxlR5
InChI InChI=1S/C18H24O5/c1-18(2,3)23-16(21)8-10-7-11-15(9-13(10)20)22-14-6-4-5-12(19)17(11)14/h10-11,15H,4-9H2,1-3H3/t10-,11+,15-/m1/s1
InChIKey AXAUBPRKXJORCC-JRPNMDOOSA-N
Mol Weight 320.39 g/mol
Molecular Formula C18H24O5
Exact Mass 320.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHMv5so6jBa
Name (2R,4aR,9bR)-tert-Butyl 2-(3,9-dioxo-1,2,3,4,4a,6,7,8,9,9b-decahydrodibenzo[b,d]furan-2-yl)acetate
Appearance White solid
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Exact Mass 320.162373868 u
Formula C18H24O5
GC Column HP-5MS (15 m x 0.25 mm)
InChI InChI=1S/C18H24O5/c1-18(2,3)23-16(21)8-10-7-11-15(9-13(10)20)22-14-6-4-5-12(19)17(11)14/h10-11,15H,4-9H2,1-3H3/t10-,11+,15-/m1/s1
InChIKey AXAUBPRKXJORCC-JRPNMDOOSA-N
Instrument Name Hewlett Packard Model 6890 GC-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201505027
Molecular Weight 320.385 g/mol
Quality 112
SMILES [C@@]1(CC(OC(C)(C)C)=O)(C[C@]2([C@@](OC=3CCCC(C23)=O)([H])CC1=O)[H])[H]
SPLASH splash10-0a4j-3290000000-6cfcc79c819830b9ca35
Sample Comments Mixture of diastereomers (>20:1)
Source of Spectrum QE-22-SM7-3e (DOI: 10.1002/chem.201505027)
Thin-Layer Chromatography 0.40 (hexanes/EtOAc, 1:2)
Wiley ID 1903649