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3,6,9,12,15,18,21,24,27,30-Decaoxahentriacontanoic acid, tbdms derivative

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3,6,9,12,15,18,21,24,27,30-Decaoxahentriacontanoic acid, tbdms derivative
SpectraBase Compound ID 4lBtKPd9NFB
InChI InChI=1S/C27H56O12Si/c1-27(2,3)40(5,6)39-26(28)25-38-24-23-37-22-21-36-20-19-35-18-17-34-16-15-33-14-13-32-12-11-31-10-9-30-8-7-29-4/h7-25H2,1-6H3
InChIKey NMQZNXOWLDROTE-UHFFFAOYSA-N
Mol Weight 600.8 g/mol
Molecular Formula C27H56O12Si
Exact Mass 600.354104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7XbwBErsHDa
Name 3,6,9,12,15,18,21,24,27,30-Decaoxahentriacontanoic acid, tbdms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 600.354103766 u
Formula C27H56O12Si
InChI InChI=1S/C27H56O12Si/c1-27(2,3)40(5,6)39-26(28)25-38-24-23-37-22-21-36-20-19-35-18-17-34-16-15-33-14-13-32-12-11-31-10-9-30-8-7-29-4/h7-25H2,1-6H3
InChIKey NMQZNXOWLDROTE-UHFFFAOYSA-N
Molecular Weight 600.818 g/mol
SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCOCC(O[Si](C(C)(C)C)(C)C)=O