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Hexadecanedioic acid, 2tbdms derivative

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Hexadecanedioic acid, 2tbdms derivative
SpectraBase Compound ID 4m5k8u08JMz
InChI InChI=1S/C28H58O4Si2/c1-27(2,3)33(7,8)31-25(29)23-21-19-17-15-13-11-12-14-16-18-20-22-24-26(30)32-34(9,10)28(4,5)6/h11-24H2,1-10H3
InChIKey CCEXWIDNWFSMFB-UHFFFAOYSA-N
Mol Weight 514.9 g/mol
Molecular Formula C28H58O4Si2
Exact Mass 514.387363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AvtDT4hCUJT
Name Hexadecanedioic acid, 2tbdms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 514.387363414 u
Formula C28H58O4Si2
InChI InChI=1S/C28H58O4Si2/c1-27(2,3)33(7,8)31-25(29)23-21-19-17-15-13-11-12-14-16-18-20-22-24-26(30)32-34(9,10)28(4,5)6/h11-24H2,1-10H3
InChIKey CCEXWIDNWFSMFB-UHFFFAOYSA-N
Molecular Weight 514.938 g/mol
SMILES C[Si](C(C)(C)C)(OC(=O)CCCCCCCCCCCCCCC(O[Si](C)(C(C)(C)C)C)=O)C