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3,6,9,12,15,18,21-Heptaoxadocosan-1-ol, tbdms derivative
SpectraBase Compound ID 6gDtkb0xmiJ
InChI InChI=1S/C21H46O8Si/c1-21(2,3)30(5,6)29-20-19-28-18-17-27-16-15-26-14-13-25-12-11-24-10-9-23-8-7-22-4/h7-20H2,1-6H3
InChIKey HHVRGNBRUOGTGD-UHFFFAOYSA-N
Mol Weight 454.7 g/mol
Molecular Formula C21H46O8Si
Exact Mass 454.296195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AKLxacciWiG
Name 3,6,9,12,15,18,21-Heptaoxadocosan-1-ol, tbdms derivative
Comments Computed using HOSE algorithm
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Exact Mass 454.296194968 u
Formula C21H46O8Si
InChI InChI=1S/C21H46O8Si/c1-21(2,3)30(5,6)29-20-19-28-18-17-27-16-15-26-14-13-25-12-11-24-10-9-23-8-7-22-4/h7-20H2,1-6H3
InChIKey HHVRGNBRUOGTGD-UHFFFAOYSA-N
Molecular Weight 454.676 g/mol
SMILES COCCOCCOCCOCCOCCOCCOCCO[Si](C)(C(C)(C)C)C