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(3aR,4R,8S,9S,13R,13aR)-2,2-dimethyl-8,9-bis(phenylmethoxy)-6,7,10,11-tetradehydro-3a,4,5,8,9,12,13,13a-octahydrocyclododeca[d][1,3]dioxole-4,13-diol

View entire compound with spectra: 1 MS (GC)

(3aR,4R,8S,9S,13R,13aR)-2,2-dimethyl-8,9-bis(phenylmethoxy)-6,7,10,11-tetradehydro-3a,4,5,8,9,12,13,13a-octahydrocyclododeca[d][1,3]dioxole-4,13-diol
SpectraBase Compound ID FG3D74EFUaJ
InChI InChI=1S/C29H32O6/c1-29(2)34-27-23(30)15-9-17-25(32-19-21-11-5-3-6-12-21)26(18-10-16-24(31)28(27)35-29)33-20-22-13-7-4-8-14-22/h3-8,11-14,23-28,30-31H,15-16,19-20H2,1-2H3/t23-,24-,25+,26+,27-,28-/m1/s1
InChIKey ZCTGXIOZKSMINV-BNNSEFEDSA-N
Mol Weight 476.6 g/mol
Molecular Formula C29H32O6
Exact Mass 476.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QxfgdDT5qE
Name (3aR,4R,8S,9S,13R,13aR)-2,2-dimethyl-8,9-bis(phenylmethoxy)-6,7,10,11-tetradehydro-3a,4,5,8,9,12,13,13a-octahydrocyclododeca[d][1,3]dioxole-4,13-diol
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Formula C29H32O6
InChI InChI=1S/C29H32O6/c1-29(2)34-27-23(30)15-9-17-25(32-19-21-11-5-3-6-12-21)26(18-10-16-24(31)28(27)35-29)33-20-22-13-7-4-8-14-22/h3-8,11-14,23-28,30-31H,15-16,19-20H2,1-2H3/t23-,24-,25+,26+,27-,28-/m1/s1
InChIKey ZCTGXIOZKSMINV-BNNSEFEDSA-N
Molecular Weight 476.569 g/mol
SMILES O[C@]1([C@@]2([C@@]([C@@](CC#C[C@@]([C@](C#CC1)(OCc1ccccc1)[H])(OCc1ccccc1)[H])(O)[H])(OC(O2)(C)C)[H])[H])[H]
SPLASH splash10-0006-9000100000-732d60528d607bb3db06
Source of Spectrum KC-0-740-17
Synonyms (3aR,4R,8S,9S,13R,13aR)-8,9-dibenzoxy-2,2-dimethyl-6,7,10,11-tetradehydro-3a,4,5,8,9,12,13,13a-octahydrocyclododeca[d][1,3]dioxole-4,13-diol (3aR,4R,8S,9S,13R,13aR)-8,9-dibenzyloxy-2,2-dimethyl-6,7,10,11-tetradehydro-3a,4,5,8,9,12,13,13a-octahydrocyclododeca[d][1,3]dioxole-4,13-diol
Wiley ID 830087