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Diacetone-D-galacturonic acid, tbdms derivative
SpectraBase Compound ID 8aaLcYumfdw
InChI InChI=1S/C18H32O7Si/c1-16(2,3)26(8,9)25-14(19)12-10-11(22-17(4,5)21-10)13-15(20-12)24-18(6,7)23-13/h10-13,15H,1-9H3
InChIKey SEMSTHMQNKPVEX-UHFFFAOYSA-N
Mol Weight 388.5 g/mol
Molecular Formula C18H32O7Si
Exact Mass 388.19173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2gSiTAN6VZ6
Name Diacetone-D-galacturonic acid, tbdms derivative
Comments Computed using HOSE algorithm
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Exact Mass 388.191729898 u
Formula C18H32O7Si
InChI InChI=1S/C18H32O7Si/c1-16(2,3)26(8,9)25-14(19)12-10-11(22-17(4,5)21-10)13-15(20-12)24-18(6,7)23-13/h10-13,15H,1-9H3
InChIKey SEMSTHMQNKPVEX-UHFFFAOYSA-N
Molecular Weight 388.532 g/mol
SMILES C12C3C(C(OC2OC(O1)(C)C)C(O[Si](C)(C)C(C)(C)C)=O)OC(O3)(C)C