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Methyl [(1R)-(1.alpha.,4.alpha.,5.beta.)-4-(benzoyloxy)-5-[[(benzyloxy)methyl]oxy]-1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-cyclohexene-1-carboxylate

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

Methyl [(1R)-(1.alpha.,4.alpha.,5.beta.)-4-(benzoyloxy)-5-[[(benzyloxy)methyl]oxy]-1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-cyclohexene-1-carboxylate
SpectraBase Compound ID J1MdRARhZ8b
InChI InChI=1S/C29H38O7Si/c1-28(2,3)37(5,6)36-29(27(31)32-4)18-17-24(35-26(30)23-15-11-8-12-16-23)25(19-29)34-21-33-20-22-13-9-7-10-14-22/h7-18,24-25H,19-21H2,1-6H3/t24-,25-,29+/m1/s1
InChIKey FNQAZGYDTRMLKB-MIHVYDCKSA-N
Mol Weight 526.7 g/mol
Molecular Formula C29H38O7Si
Exact Mass 526.23868 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J4j5f9HQcy0
Name Methyl [(1R)-(1.alpha.,4.alpha.,5.beta.)-4-(benzoyloxy)-5-[[(benzyloxy)methyl]oxy]-1-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2-cyclohexene-1-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 526.238680092 u
Formula C29H38O7Si
InChI InChI=1S/C29H38O7Si/c1-28(2,3)37(5,6)36-29(27(31)32-4)18-17-24(35-26(30)23-15-11-8-12-16-23)25(19-29)34-21-33-20-22-13-9-7-10-14-22/h7-18,24-25H,19-21H2,1-6H3/t24-,25-,29+/m1/s1
InChIKey FNQAZGYDTRMLKB-MIHVYDCKSA-N
Molecular Weight 526.701 g/mol
SMILES [C@]1(O[Si](C(C)(C)C)(C)C)(C[C@@](OCOCC=2C=CC=CC2)([C@](OC(=O)C2=CC=CC=C2)(C=C1)[H])[H])C(=O)OC