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Benzyl (2'S,3'S,6'R,8'R)-8'-O-tert-Butyldimethylsilyl-8-nonactinoyl-(2R,3R,6S,8S)-nonactate
SpectraBase Compound ID HrNWDXH0fyX
InChI InChI=1S/C33H54O7Si/c1-22(19-27-15-17-29(38-27)24(3)31(34)36-21-26-13-11-10-12-14-26)37-32(35)25(4)30-18-16-28(39-30)20-23(2)40-41(8,9)33(5,6)7/h10-14,22-25,27-30H,15-21H2,1-9H3/t22-,23+,24+,25-,27-,28+,29+,30-/m0/s1
InChIKey SMBWQKKHKYBWMT-DUDLOACESA-N
Mol Weight 590.9 g/mol
Molecular Formula C33H54O7Si
Exact Mass 590.363881 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRjIkFNkXsz
Name Benzyl (2'S,3'S,6'R,8'R)-8'-O-tert-Butyldimethylsilyl-8-nonactinoyl-(2R,3R,6S,8S)-nonactate
Comments Less than 3 mono-isotopic peaks
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Formula C33H54O7Si
InChI InChI=1S/C33H54O7Si/c1-22(19-27-15-17-29(38-27)24(3)31(34)36-21-26-13-11-10-12-14-26)37-32(35)25(4)30-18-16-28(39-30)20-23(2)40-41(8,9)33(5,6)7/h10-14,22-25,27-30H,15-21H2,1-9H3/t22-,23+,24+,25-,27-,28+,29+,30-/m0/s1
InChIKey SMBWQKKHKYBWMT-DUDLOACESA-N
Molecular Weight 590.873 g/mol
SMILES C([C@]([C@]1(O[C@](C[C@](O[Si](C(C)(C)C)(C)C)(C)[H])([H])CC1)[H])(C)[H])(O[C@](C[C@]1(O[C@]([C@](C(OCc2ccccc2)=O)(C)[H])([H])CC1)[H])(C)[H])=O
SPLASH splash10-0006-9000000000-02cd33a7349638251c21
Source of Spectrum KC-0-2745-27
Synonyms (2R)-2-[(2R,5S)-5-[(2S)-2-[(2S)-2-[(2S,5R)-5-[(2R)-2-[tert-butyl(dimethyl)silyl]oxypropyl]-2-oxolanyl]-1-oxopropoxy]propyl]-2-oxolanyl]propanoic acid (phenylmethyl) ester benzyl (2R)-2-[(2R,5S)-5-[(2S)-2-[(2S)-2-[(2S,5R)-5-[(2R)-2-[tert-butyl(dimethyl)silyl]oxypropyl]oxolan-2-yl]propanoyl]oxypropyl]oxolan-2-yl]propanoate benzyl (2R)-2-[(2R,5S)-5-[(2S)-2-[(2S)-2-[(2S,5R)-5-[(2R)-2-[tert-butyl(dimethyl)silyl]oxypropyl]tetrahydrofuran-2-yl]propanoyl]oxypropyl]tetrahydrofuran-2-yl]propanoate (phenylmethyl) (2R)-2-[(2R,5S)-5-[(2S)-2-[(2S)-2-[(2S,5R)-5-[(2R)-2-[tert-butyl(dimethyl)silyl]oxypropyl]oxolan-2-yl]propanoyl]oxypropyl]oxolan-2-yl]propanoate
Wiley ID 826150