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(4R,4aS,8aR)-4-hydroxy-8a-methyl-4,4a,6,7,8,9-hexahydrobenzo[f]benzofuran-5-one
SpectraBase Compound ID J21kw7tyXI0
InChI InChI=1S/C13H16O3/c1-13-5-2-3-9(14)11(13)12(15)8-4-6-16-10(8)7-13/h4,6,11-12,15H,2-3,5,7H2,1H3/t11-,12+,13-/m1/s1
InChIKey ZLIGGEQPMSJZPM-FRRDWIJNSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91ckoFvCBby
Name (4R,4aS,8aR)-4-hydroxy-8a-methyl-4,4a,6,7,8,9-hexahydrobenzo[f]benzofuran-5-one
Alternate Name(s) (4R,4aS,8aR)-4-hydroxy-8a-methyl-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran-5-one (4R,4aS,8aR)-8a-methyl-4-oxidanyl-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran-5-one
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Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-13-5-2-3-9(14)11(13)12(15)8-4-6-16-10(8)7-13/h4,6,11-12,15H,2-3,5,7H2,1H3/t11-,12+,13-/m1/s1
InChIKey ZLIGGEQPMSJZPM-FRRDWIJNSA-N
Molecular Weight 220.268 g/mol
SMILES O[C@]1(c2c(C[C@]3(CCCC([C@]13[H])=O)C)occ2)[H]
SPLASH splash10-0uei-9310000000-783ff67bc983cafcb15e
Source of Spectrum KC-1993-246-35
Wiley ID 778868