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di-tms-2-Oxophytanate-enol

View entire compound with spectra: 1 NMR, and 1 MS (GC)

di-tms-2-Oxophytanate-enol
SpectraBase Compound ID IdPoZP3tHqK
InChI InChI=1S/C26H54O3Si2/c1-21(2)15-12-16-22(3)17-13-18-23(4)19-14-20-24(5)25(28-30(6,7)8)26(27)29-31(9,10)11/h21-23H,12-20H2,1-11H3/b25-24+
InChIKey PVFYPXIMYCKSHN-OCOZRVBESA-N
Mol Weight 470.9 g/mol
Molecular Formula C26H54O3Si2
Exact Mass 470.361149 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Kvb8zTG25D
Name di-tms-2-Oxophytanate-enol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.361148666 u
Formula C26H54O3Si2
InChI InChI=1S/C26H54O3Si2/c1-21(2)15-12-16-22(3)17-13-18-23(4)19-14-20-24(5)25(28-30(6,7)8)26(27)29-31(9,10)11/h21-23H,12-20H2,1-11H3/b25-24+
InChIKey PVFYPXIMYCKSHN-OCOZRVBESA-N
Molecular Weight 470.885 g/mol
SMILES C(\C(O[Si](C)(C)C)=C/(CCCC(CCCC(CCCC(C)C)C)C)C)(O[Si](C)(C)C)=O