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(4aS,6R,7S,9aS)-[7-(tert-Butyldimethylsiloxy)-2,3,4,4a,8,9-hexahydropyran[3,2-b[oxepane-6-yl]iodomethane
SpectraBase Compound ID BI7R3oFEmXy
InChI InChI=1S/C16H31IO3Si/c1-16(2,3)21(4,5)20-14-9-8-12-13(7-6-10-18-12)19-15(14)11-17/h12-15H,6-11H2,1-5H3/t12-,13+,14+,15+/m1/s1
InChIKey XVBMFCJMTRDLJO-QPSCCSFWSA-N
Mol Weight 426.41 g/mol
Molecular Formula C16H31IO3Si
Exact Mass 426.108716 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 84gc3BAUGVf
Name (4aS,6R,7S,9aS)-[7-(tert-Butyldimethylsiloxy)-2,3,4,4a,8,9-hexahydropyran[3,2-b[oxepane-6-yl]iodomethane
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Formula C16H31IO3Si
InChI InChI=1S/C16H31IO3Si/c1-16(2,3)21(4,5)20-14-9-8-12-13(7-6-10-18-12)19-15(14)11-17/h12-15H,6-11H2,1-5H3/t12-,13+,14+,15+/m1/s1
InChIKey XVBMFCJMTRDLJO-QPSCCSFWSA-N
Molecular Weight 426.410 g/mol
SMILES [C@@]1(O[C@@]2([C@@](CC[C@@]1(O[Si](C(C)(C)C)(C)C)[H])(OCCC2)[H])[H])(CI)[H]
SPLASH splash10-00xs-8901000000-a057695877d56ac3b677
Source of Spectrum J-59-2873-117
Synonyms (4aS,6R,7S,9aR)-[7-(tert-Butyldimethylsiloxy)-2,3,4,4a,8,9-hexahydropyran[3,2-b[oxepane-6-yl]iodomethane (4aS,6R,7S,9aS)-6-(iodomethyl)octahydro-2H-pyrano[3,2-b]oxepin-7-yl tert-butyl(dimethyl)silyl ether {[(4aS,6R,7S,9aS)-6-(iodomethyl)octahydro-2H-pyrano[3,2-b]oxepin-7-yl]oxy}(tert-butyl)dimethylsilane
Wiley ID 1379784