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9R,16-Dihydroxypalmitic acid, 3-o-tms

View entire compound with spectra: 1 NMR

9R,16-Dihydroxypalmitic acid, 3-o-tms
SpectraBase Compound ID hkPmwNhsIT
InChI InChI=1S/C25H56O4Si3/c1-30(2,3)27-23-19-15-11-13-17-21-24(28-31(4,5)6)20-16-12-10-14-18-22-25(26)29-32(7,8)9/h24H,10-23H2,1-9H3
InChIKey NDDAQQCBRAFDHR-UHFFFAOYSA-N
Mol Weight 505.0 g/mol
Molecular Formula C25H56O4Si3
Exact Mass 504.34864 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 808Ci6eBtxc
Name 9R,16-Dihydroxypalmitic acid, 3-o-tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 504.348639884 u
Formula C25H56O4Si3
InChI InChI=1S/C25H56O4Si3/c1-30(2,3)27-23-19-15-11-13-17-21-24(28-31(4,5)6)20-16-12-10-14-18-22-25(26)29-32(7,8)9/h24H,10-23H2,1-9H3
InChIKey NDDAQQCBRAFDHR-UHFFFAOYSA-N
Molecular Weight 504.974 g/mol
SMILES C(CCCCCCCC(CCCCCCCO[Si](C)(C)C)O[Si](C)(C)C)(=O)O[Si](C)(C)C