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(3bS,5aR,7R,9aR,9bR)-3b-(hydroxymethyl)-6,6,9a-trimethyl-7-oxidanyl-4,5,5a,7,9,9b,10,11-octahydronaphtho[2,1-e][2]benzofuran-8-one

View entire compound with spectra: 1 MS (GC)

(3bS,5aR,7R,9aR,9bR)-3b-(hydroxymethyl)-6,6,9a-trimethyl-7-oxidanyl-4,5,5a,7,9,9b,10,11-octahydronaphtho[2,1-e][2]benzofuran-8-one
SpectraBase Compound ID 2leoB76RFgO
InChI InChI=1S/C20H28O4/c1-18(2)15-6-7-20(11-21)13-10-24-9-12(13)4-5-16(20)19(15,3)8-14(22)17(18)23/h9-10,15-17,21,23H,4-8,11H2,1-3H3/t15-,16+,17-,19-,20+/m0/s1
InChIKey UWPBUVZNLJKNQJ-SQIBXOBRSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWqPvM5Fzj9
Name (3bS,5aR,7R,9aR,9bR)-3b-(hydroxymethyl)-6,6,9a-trimethyl-7-oxidanyl-4,5,5a,7,9,9b,10,11-octahydronaphtho[2,1-e][2]benzofuran-8-one
Alternate Name(s) (3bS,5aR,7R,9aR,9bR)-7-hydroxy-3b-(hydroxymethyl)-6,6,9a-trimethyl-4,5,5a,7,9,9b,10,11-octahydronaphtho[2,1-e]isobenzofuran-8-one (3bS,5aR,7R,9aR,9bR)-7-hydroxy-3b-(hydroxymethyl)-6,6,9a-trimethyl-4,5,5a,7,9,9b,10,11-octahydronaphtho[2,1-e][2]benzofuran-8-one (3bS,5aR,7R,9aR,9bR)-7-hydroxy-6,6,9a-trimethyl-3b-methylol-4,5,5a,7,9,9b,10,11-octahydronaphth[2,1-e]isobenzofuran-8-one
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Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-18(2)15-6-7-20(11-21)13-10-24-9-12(13)4-5-16(20)19(15,3)8-14(22)17(18)23/h9-10,15-17,21,23H,4-8,11H2,1-3H3/t15-,16+,17-,19-,20+/m0/s1
InChIKey UWPBUVZNLJKNQJ-SQIBXOBRSA-N
Molecular Weight 332.440 g/mol
SMILES OC[C@@]12[C@@]([C@]3(CC([C@@](C([C@@]3(CC2)[H])(C)C)(O)[H])=O)C)(CCc2cocc12)[H]
SPLASH splash10-0udi-0019000000-b9db93dee6e8ad09a179
Source of Spectrum F-50-9905-7
Wiley ID 1329645