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Isopropyl (2S,3S,6R)-7-(t-butylcarbonyl)-2,3-bis[t-butyldimethylsilyloxy]-6-hydroxy-4-oxoheptanoate

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Isopropyl (2S,3S,6R)-7-(t-butylcarbonyl)-2,3-bis[t-butyldimethylsilyloxy]-6-hydroxy-4-oxoheptanoate
SpectraBase Compound ID 99vVNkHTHOx
InChI InChI=1S/C27H54O8Si2/c1-18(2)32-24(31)23(35-37(14,15)27(9,10)11)22(34-36(12,13)26(6,7)8)20(29)16-19(28)17-21(30)33-25(3,4)5/h18-19,22-23,28H,16-17H2,1-15H3/t19-,22-,23+/m0/s1
InChIKey XIKCKIDMXJJILP-AJSBUHFISA-N
Mol Weight 562.9 g/mol
Molecular Formula C27H54O8Si2
Exact Mass 562.335722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AulUwJZUyGi
Name Isopropyl (2S,3S,6R)-7-(T-butylcarbonyl)-2,3-bis[T-butyldimethylsilyloxy]-6-hydroxy-4-oxoheptanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 562.335721761 u
Formula C27H54O8Si2
InChI InChI=1S/C27H54O8Si2/c1-18(2)32-24(31)23(35-37(14,15)27(9,10)11)22(34-36(12,13)26(6,7)8)20(29)16-19(28)17-21(30)33-25(3,4)5/h18-19,22-23,28H,16-17H2,1-15H3/t19-,22-,23+/m0/s1
InChIKey XIKCKIDMXJJILP-AJSBUHFISA-N
Molecular Weight 562.891 g/mol
SMILES [C@]([C@@](O[Si](C(C)(C)C)(C)C)(C(C[C@@](CC(OC(C)(C)C)=O)(O)[H])=O)[H])(C(OC(C)C)=O)(O[Si](C(C)(C)C)(C)C)[H]