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S-tert-Butyl (2R,3S,4R,5R)-4-Benzyloxy-5-[(tert-butyldimethylsilyl)oxy]-3-hydroxy-2-methoxy-8-methyl-6-nonynethioate
SpectraBase Compound ID 4FBaNfXbI1y
InChI InChI=1S/C28H46O5SSi/c1-20(2)17-18-22(33-35(10,11)28(6,7)8)24(32-19-21-15-13-12-14-16-21)23(29)25(31-9)26(30)34-27(3,4)5/h12-16,20,22-25,29H,19H2,1-11H3/t22-,23+,24+,25-/m1/s1
InChIKey NXJYGNSDHHULJK-WSOYEBOPSA-N
Mol Weight 522.8 g/mol
Molecular Formula C28H46O5SSi
Exact Mass 522.283522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EJaKDpJphQ
Name S-tert-Butyl (2R,3S,4R,5R)-4-Benzyloxy-5-[(tert-butyldimethylsilyl)oxy]-3-hydroxy-2-methoxy-8-methyl-6-nonynethioate
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Formula C28H46O5SSi
InChI InChI=1S/C28H46O5SSi/c1-20(2)17-18-22(33-35(10,11)28(6,7)8)24(32-19-21-15-13-12-14-16-21)23(29)25(31-9)26(30)34-27(3,4)5/h12-16,20,22-25,29H,19H2,1-11H3/t22-,23+,24+,25-/m1/s1
InChIKey NXJYGNSDHHULJK-WSOYEBOPSA-N
Molecular Weight 522.816 g/mol
SMILES O[C@]([C@](C(SC(C)(C)C)=O)(OC)[H])([C@]([C@@](C#CC(C)C)(O[Si](C(C)(C)C)(C)C)[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-052f-9010000000-785937739ec85bf5c489
Source of Spectrum J-60-5917-46
Synonyms (2R,3S,4R,5R)-4-(benzyloxy)-5-[(tert-butyldimethylsilyl)oxy]-1-(tert-butylsulfanyl)-3-hydroxy-2-methoxy-8-methylnon-6-yn-1-one
Wiley ID 1402242