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Benzyl 2,6-di-o-acetyl-3,4-o-isopropylidene-.alpha.-D-galactopyranoside
SpectraBase Compound ID T2lajSuvsT
InChI InChI=1S/C20H26O8/c1-12(21)23-11-15-16-17(28-20(3,4)27-16)18(25-13(2)22)19(26-15)24-10-14-8-6-5-7-9-14/h5-9,15-19H,10-11H2,1-4H3/t15-,16+,17+,18-,19+/m1/s1
InChIKey HMYRWRBJAWWTBA-SPOLIRPYSA-N
Mol Weight 394.42 g/mol
Molecular Formula C20H26O8
Exact Mass 394.162768 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4R5J7EipC5C
Name Benzyl 2,6-di-o-acetyl-3,4-o-isopropylidene-.alpha.-D-galactopyranoside
Comments Computed using HOSE algorithm
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Exact Mass 394.162767789 u
Formula C20H26O8
InChI InChI=1S/C20H26O8/c1-12(21)23-11-15-16-17(28-20(3,4)27-16)18(25-13(2)22)19(26-15)24-10-14-8-6-5-7-9-14/h5-9,15-19H,10-11H2,1-4H3/t15-,16+,17+,18-,19+/m1/s1
InChIKey HMYRWRBJAWWTBA-SPOLIRPYSA-N
Molecular Weight 394.420 g/mol
SMILES [C@]12([C@]([C@@](OCC=3C=CC=CC3)(O[C@@]([C@@]1(OC(O2)(C)C)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])[H]