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5,6-Octadienoic acid, 8-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, methyl ester, (S)-
SpectraBase Compound ID 8Z7I8oQ5fDd
InChI InChI=1S/C25H32O3Si/c1-25(2,3)29(22-16-10-8-11-17-22,23-18-12-9-13-19-23)28-21-15-7-5-6-14-20-24(26)27-4/h5,8-13,15-19H,6,14,20-21H2,1-4H3
InChIKey HRTLDURBLLJFFL-UHFFFAOYSA-N
Mol Weight 408.6 g/mol
Molecular Formula C25H32O3Si
Exact Mass 408.212071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2I0N5Xx12VK
Name 5,6-Octadienoic acid, 8-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-, methyl ester, (S)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.212071422 u
Formula C25H32O3Si
InChI InChI=1S/C25H32O3Si/c1-25(2,3)29(22-16-10-8-11-17-22,23-18-12-9-13-19-23)28-21-15-7-5-6-14-20-24(26)27-4/h5,8-13,15-19H,6,14,20-21H2,1-4H3
InChIKey HRTLDURBLLJFFL-UHFFFAOYSA-N
Molecular Weight 408.613 g/mol
SMILES C([Si](C=1C=CC=CC1)(C1=CC=CC=C1)OCC=C=CCCCC(=O)OC)(C)(C)C