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3,6,9,12,15,18,21-Heptaoxadocosanoic acid, tbdms derivative
SpectraBase Compound ID E6zR9e3NgEl
InChI InChI=1S/C21H44O9Si/c1-21(2,3)31(5,6)30-20(22)19-29-18-17-28-16-15-27-14-13-26-12-11-25-10-9-24-8-7-23-4/h7-19H2,1-6H3
InChIKey RRSAPJSWOOHOKB-UHFFFAOYSA-N
Mol Weight 468.7 g/mol
Molecular Formula C21H44O9Si
Exact Mass 468.27546 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G35MqsMgnNy
Name 3,6,9,12,15,18,21-Heptaoxadocosanoic acid, tbdms derivative
Comments Computed using HOSE algorithm
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Exact Mass 468.275459523 u
Formula C21H44O9Si
InChI InChI=1S/C21H44O9Si/c1-21(2,3)31(5,6)30-20(22)19-29-18-17-28-16-15-27-14-13-26-12-11-25-10-9-24-8-7-23-4/h7-19H2,1-6H3
InChIKey RRSAPJSWOOHOKB-UHFFFAOYSA-N
Molecular Weight 468.659 g/mol
SMILES COCCOCCOCCOCCOCCOCCOCC(O[Si](C(C)(C)C)(C)C)=O