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(3S,4R,5R,6S,7S)-3-Acetoxy-1,8-bis[(tert-butyldimethylsilyl)oxy]-4-(dibenzylamino)-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(3S,4R,5R,6S,7S)-3-Acetoxy-1,8-bis[(tert-butyldimethylsilyl)oxy]-4-(dibenzylamino)-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane
SpectraBase Compound ID 45zaQTVert1
InChI InChI=1S/C41H69NO8Si2/c1-31(43)48-34(25-26-46-51(11,12)39(2,3)4)36(42(27-32-21-17-15-18-22-32)28-33-23-19-16-20-24-33)38(45-30-44-10)37-35(49-41(8,9)50-37)29-47-52(13,14)40(5,6)7/h15-24,34-38H,25-30H2,1-14H3/t34-,35-,36+,37+,38+/m0/s1
InChIKey NVYDTSCZCIKBSY-JACQBIKPSA-N
Mol Weight 760.2 g/mol
Molecular Formula C41H69NO8Si2
Exact Mass 759.456171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 50B00kfABcj
Name (3S,4R,5R,6S,7S)-3-Acetoxy-1,8-bis[(tert-butyldimethylsilyl)oxy]-4-(dibenzylamino)-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 759.456171248 u
Formula C41H69NO8Si2
InChI InChI=1S/C41H69NO8Si2/c1-31(43)48-34(25-26-46-51(11,12)39(2,3)4)36(42(27-32-21-17-15-18-22-32)28-33-23-19-16-20-24-33)38(45-30-44-10)37-35(49-41(8,9)50-37)29-47-52(13,14)40(5,6)7/h15-24,34-38H,25-30H2,1-14H3/t34-,35-,36+,37+,38+/m0/s1
InChIKey NVYDTSCZCIKBSY-JACQBIKPSA-N
Molecular Weight 760.172 g/mol
SMILES [C@@]1([C@@]([C@](N(CC=2C=CC=CC2)CC=2C=CC=CC2)([C@@](OC(=O)C)(CCO[Si](C(C)(C)C)(C)C)[H])[H])(OCOC)[H])([C@@](OC(O1)(C)C)(CO[Si](C(C)(C)C)(C)C)[H])[H]