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1-Allyloxy-3-(7-bromo-1,1-dimethylheptyl)-6-methyl-6-[3-(tert-butyldimethylsiloxy)propynyl]-9,9-dimethoxy-6a,7,8,9,10,10a-hexahydrobenzo[b]chroman
SpectraBase Compound ID 2oVewnkzokd
InChI InChI=1S/C37H59BrO5Si/c1-12-23-41-31-25-28(35(5,6)19-15-13-14-16-22-38)26-32-33(31)29-27-37(39-8,40-9)21-18-30(29)36(7,43-32)20-17-24-42-44(10,11)34(2,3)4/h12,25-26,29-30H,1,13-16,18-19,21-24,27H2,2-11H3/t29-,30?,36+/m1/s1
InChIKey SAZPVGWXMTZNOP-WWOWXYNFSA-N
Mol Weight 691.9 g/mol
Molecular Formula C37H59BrO5Si
Exact Mass 690.331515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FWmE9xOP4Tq
Name 1-Allyloxy-3-(7-bromo-1,1-dimethylheptyl)-6-methyl-6-[3-(tert-butyldimethylsiloxy)propynyl]-9,9-dimethoxy-6a,7,8,9,10,10a-hexahydrobenzo[b]chroman
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Formula C37H59BrO5Si
InChI InChI=1S/C37H59BrO5Si/c1-12-23-41-31-25-28(35(5,6)19-15-13-14-16-22-38)26-32-33(31)29-27-37(39-8,40-9)21-18-30(29)36(7,43-32)20-17-24-42-44(10,11)34(2,3)4/h12,25-26,29-30H,1,13-16,18-19,21-24,27H2,2-11H3/t29-,30?,36+/m1/s1
InChIKey SAZPVGWXMTZNOP-WWOWXYNFSA-N
Molecular Weight 691.863 g/mol
SMILES c12[C@]3(C(CCC(C3)(OC)OC)[C@@](Oc1cc(cc2OCC=C)C(CCCCCCBr)(C)C)(C#CCO[Si](C(C)(C)C)(C)C)C)[H]
SPLASH splash10-014i-9400001000-93f280c626d6744397b0
Source of Spectrum J-68-60-12
Wiley ID 1536203