For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid, 3tms

View entire compound with spectra: 1 NMR

9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid, 3tms
SpectraBase Compound ID KfA2jniKzWS
InChI InChI=1S/C21H46O6Si3/c1-28(2,3)25-18-19(26-29(4,5)6)17-24-20(22)15-13-11-10-12-14-16-21(23)27-30(7,8)9/h19H,10-18H2,1-9H3
InChIKey ODMOBBRSPRDWFG-UHFFFAOYSA-N
Mol Weight 478.8 g/mol
Molecular Formula C21H46O6Si3
Exact Mass 478.260219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8HMgp4VfXVY
Name 9-(2,3-Dihydroxypropoxy)-9-oxononanoic acid, 3tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.260218800 u
Formula C21H46O6Si3
InChI InChI=1S/C21H46O6Si3/c1-28(2,3)25-18-19(26-29(4,5)6)17-24-20(22)15-13-11-10-12-14-16-21(23)27-30(7,8)9/h19H,10-18H2,1-9H3
InChIKey ODMOBBRSPRDWFG-UHFFFAOYSA-N
Molecular Weight 478.848 g/mol
SMILES C[Si](C)(C)OC(CCCCCCCC(=O)OCC(CO[Si](C)(C)C)O[Si](C)(C)C)=O