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2-(2-Phenylethoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol, 6tms derivative
SpectraBase Compound ID E0n7mRDKRFq
InChI InChI=1S/C37H76O10Si6/c1-48(2,3)42-30-27-40-36(34(46-52(13,14)15)32(30)44-50(7,8)9)39-26-29-31(43-49(4,5)6)33(45-51(10,11)12)35(47-53(16,17)18)37(41-29)38-25-24-28-22-20-19-21-23-28/h19-23,29-37H,24-27H2,1-18H3
InChIKey AFWFDGADIVYOIA-UHFFFAOYSA-N
Mol Weight 849.5 g/mol
Molecular Formula C37H76O10Si6
Exact Mass 848.405408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 47h4368CqGP
Name 2-(2-Phenylethoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol, 6tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 848.405407847 u
Formula C37H76O10Si6
InChI InChI=1S/C37H76O10Si6/c1-48(2,3)42-30-27-40-36(34(46-52(13,14)15)32(30)44-50(7,8)9)39-26-29-31(43-49(4,5)6)33(45-51(10,11)12)35(47-53(16,17)18)37(41-29)38-25-24-28-22-20-19-21-23-28/h19-23,29-37H,24-27H2,1-18H3
InChIKey AFWFDGADIVYOIA-UHFFFAOYSA-N
Molecular Weight 849.515 g/mol
SMILES C1(OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)COC1OCC(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)OCCC1=CC=CC=C1