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(14S)-8,13-EPOXYLABDANE-7-BETA,14-DIOL
SpectraBase Compound ID G3o6FkO1RJw
InChI InChI=1S/C20H36O3/c1-13(21)19(5)11-8-14-18(4)10-7-9-17(2,3)15(18)12-16(22)20(14,6)23-19/h13-16,21-22H,7-12H2,1-6H3/t13-,14-,15+,16+,18-,19-,20+/m1/s1
InChIKey JAFVZFZUYSRQAD-GVUXFJDWSA-N
Mol Weight 324.5 g/mol
Molecular Formula C20H36O3
Exact Mass 324.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLk7u5Q9Gp9
Name (3R,4aS,5S,6aS,10aS,10bR)-3,4a,7,7,10a-pentamethyl-3-[(1R)-1-oxidanylethyl]-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-5-ol
Alternate Name(s) (3R,4aS,5S,6aS,10aS,10bR)-3-[(1R)-1-hydroxyethyl]-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f]chromen-5-ol (3R,4aS,5S,6aS,10aS,10bR)-3-[(1R)-1-hydroxyethyl]-3,4a,7,7,10a-pentamethyl-2,5,6,6a,8,9,10,10b-octahydro-1H-benzo[f][1]benzopyran-5-ol
CAS Registry Number 76499-26-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36O3
InChI InChI=1S/C20H36O3/c1-13(21)19(5)11-8-14-18(4)10-7-9-17(2,3)15(18)12-16(22)20(14,6)23-19/h13-16,21-22H,7-12H2,1-6H3/t13-,14-,15+,16+,18-,19-,20+/m1/s1
InChIKey JAFVZFZUYSRQAD-GVUXFJDWSA-N
Molecular Weight 324.505 g/mol
SMILES O[C@@]([C@@]1(O[C@@]2([C@](C[C@]3(C(CCC[C@@]3([C@]2(CC1)[H])C)(C)C)[H])(O)[H])C)C)(C)[H]
SPLASH splash10-02l4-7590000000-01a677c7ca44e19f45c2
Source of Spectrum J-46-1917-0
Wiley ID 1323560