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16,17-seco-16-(tert-butyldimethylsiloxy)caesaldekarin B
SpectraBase Compound ID 9aOTBFzKlJV
InChI InChI=1S/C26H46O4Si/c1-17-18(11-14-30-31(8,9)23(2,3)4)21(27)16-20-19(17)15-22(28)26(29)24(5,6)12-10-13-25(20,26)7/h11,17,19-20,22,28-29H,10,12-16H2,1-9H3/b18-11-/t17-,19-,20-,22+,25+,26+/m0/s1
InChIKey SVUKTLUEXLEHCG-NHKXKGFYSA-N
Mol Weight 450.7 g/mol
Molecular Formula C26H46O4Si
Exact Mass 450.316536 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PrfTMQ3kNS
Name 16,17-seco-16-(tert-butyldimethylsiloxy)caesaldekarin B
Alternate Name(s) (1R,2Z,4aS,4bR,8aR,9R,10aS)-2-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-1,4b,8,8-tetramethyl-8a,9-bis(oxidanyl)-4,4a,5,6,7,9,10,10a-octahydro-1H-phenanthren-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C26H46O4Si
InChI InChI=1S/C26H46O4Si/c1-17-18(11-14-30-31(8,9)23(2,3)4)21(27)16-20-19(17)15-22(28)26(29)24(5,6)12-10-13-25(20,26)7/h11,17,19-20,22,28-29H,10,12-16H2,1-9H3/b18-11-/t17-,19-,20-,22+,25+,26+/m0/s1
InChIKey SVUKTLUEXLEHCG-NHKXKGFYSA-N
Molecular Weight 450.735 g/mol
SMILES O[C@@]1(C[C@@]2([C@@]([C@@]3([C@@]1(C(CCC3)(C)C)O)C)(CC(\C([C@@]2(C)[H])=C\CO[Si](C(C)(C)C)(C)C)=O)[H])[H])[H]
SPLASH splash10-004i-9000300000-8cf88df741ba896bbd65
Source of Spectrum E1-42-1802-7
Wiley ID 1552761