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(6R,6aR,10aR)-1-allyloxy-3-(7-bromo-1,1-dimethyl-heptyl)-6-[3-[tert-butyl(dimethyl)silyl]oxyprop-1-ynyl]-6-methyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-9-ol
SpectraBase Compound ID KGbJSKo2B0v
InChI InChI=1S/C35H55BrO4Si/c1-10-21-38-30-23-26(34(5,6)18-13-11-12-14-20-36)24-31-32(30)28-25-27(37)16-17-29(28)35(7,40-31)19-15-22-39-41(8,9)33(2,3)4/h10,23-24,27-29,37H,1,11-14,16-18,20-22,25H2,2-9H3/t27?,28-,29-,35+/m1/s1
InChIKey DFKHSKJOCFOCPH-RKFXOZBCSA-N
Mol Weight 647.8 g/mol
Molecular Formula C35H55BrO4Si
Exact Mass 646.3053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWcTIUkgyu0
Name (6R,6aR,10aR)-1-allyloxy-3-(7-bromo-1,1-dimethyl-heptyl)-6-[3-[tert-butyl(dimethyl)silyl]oxyprop-1-ynyl]-6-methyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-9-ol
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Formula C35H55BrO4Si
InChI InChI=1S/C35H55BrO4Si/c1-10-21-38-30-23-26(34(5,6)18-13-11-12-14-20-36)24-31-32(30)28-25-27(37)16-17-29(28)35(7,40-31)19-15-22-39-41(8,9)33(2,3)4/h10,23-24,27-29,37H,1,11-14,16-18,20-22,25H2,2-9H3/t27?,28-,29-,35+/m1/s1
InChIKey DFKHSKJOCFOCPH-RKFXOZBCSA-N
Molecular Weight 647.810 g/mol
SMILES OC1CC[C@@]2([C@](c3c(O[C@]2(C#CCO[Si](C(C)(C)C)(C)C)C)cc(cc3OCC=C)C(CCCCCCBr)(C)C)(C1)[H])[H]
SPLASH splash10-004i-9220300000-7de89cf936fdae5e22f3
Source of Spectrum F-68-60-10
Synonyms (6R,6aR,10aR)-3-(8-bromanyl-2-methyl-octan-2-yl)-6-[3-[tert-butyl(dimethyl)silyl]oxyprop-1-ynyl]-6-methyl-1-prop-2-enoxy-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-9-ol (6R,6aR,10aR)-3-(8-bromo-2-methyloctan-2-yl)-6-[3-[tert-butyl(dimethyl)silyl]oxyprop-1-ynyl]-6-methyl-1-prop-2-enoxy-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-9-ol (6R,6aR,10aR)-3-(8-bromo-2-methyloctan-2-yl)-6-[3-[tert-butyl(dimethyl)silyl]oxyprop-1-ynyl]-6-methyl-1-prop-2-enoxy-6a,7,8,9,10,10a-hexahydrobenzo[c][1]benzopyran-9-ol
Wiley ID 1571561