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(3R,3aR,4E,8E,12S,12aS)-3,8,12-trimethyl-5-propan-2-yl-1,2,3a,6,7,10,11,12a-octahydrocyclopenta[11]annulene-3,12-diol
SpectraBase Compound ID IuTBJi0UjZN
InChI InChI=1S/C20H34O2/c1-14(2)16-9-8-15(3)7-6-11-19(4,21)17-10-12-20(5,22)18(17)13-16/h7,13-14,17-18,21-22H,6,8-12H2,1-5H3/b15-7+,16-13+/t17-,18+,19-,20+/m0/s1
InChIKey KIEHDNJPINPWIM-RGFGKLNNSA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7Y9DEEdzag
Name (3R,3aR,4E,8E,12S,12aS)-3,8,12-trimethyl-5-propan-2-yl-1,2,3a,6,7,10,11,12a-octahydrocyclopenta[11]annulene-3,12-diol
Alternate Name(s) (3R,3aR,4E,8E,12S,12aS)-5-isopropyl-3,8,12-trimethyl-1,2,3a,6,7,10,11,12a-octahydrocyclopentacycloundecene-3,12-diol (3R,3aR,4E,8E,12S,12aS)-5-isopropyl-3,8,12-trimethyl-1,2,3a,6,7,10,11,12a-octahydrocyclopenta[11]annulene-3,12-diol
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Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-14(2)16-9-8-15(3)7-6-11-19(4,21)17-10-12-20(5,22)18(17)13-16/h7,13-14,17-18,21-22H,6,8-12H2,1-5H3/b15-7+,16-13+/t17-,18+,19-,20+/m0/s1
InChIKey KIEHDNJPINPWIM-RGFGKLNNSA-N
Molecular Weight 306.490 g/mol
SMILES O[C@]1(CC\C=C\(CC\C(=C/[C@]2([C@@](CC[C@]12[H])(O)C)[H])C(C)C)C)C
SPLASH splash10-0f79-0190000000-e494cff2672b96508af5
Source of Spectrum B-39-811-3
Wiley ID 1308572