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

*Links on SpectraBase are not permalinks.

Diethylmalonic acid, decyl 2,2,3,3,3-pentafluoropropyl ester

View entire compound with spectra: 1 NMR

Diethylmalonic acid, decyl 2,2,3,3,3-pentafluoropropyl ester
SpectraBase Compound ID iBD42V3VGN
InChI InChI=1S/C20H33F5O4/c1-4-7-8-9-10-11-12-13-14-28-16(26)18(5-2,6-3)17(27)29-15-19(21,22)20(23,24)25/h4-15H2,1-3H3
InChIKey SQKSRLOBDGGEJW-UHFFFAOYSA-N
Mol Weight 432.5 g/mol
Molecular Formula C20H33F5O4
Exact Mass 432.2299 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 2EZkcQfQCjf
Name Diethylmalonic acid, decyl 2,2,3,3,3-pentafluoropropyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 432.229900354 u
Formula C20H33F5O4
InChI InChI=1S/C20H33F5O4/c1-4-7-8-9-10-11-12-13-14-28-16(26)18(5-2,6-3)17(27)29-15-19(21,22)20(23,24)25/h4-15H2,1-3H3
InChIKey SQKSRLOBDGGEJW-UHFFFAOYSA-N
Molecular Weight 432.472 g/mol
SMILES C(C(C(OCCCCCCCCCC)=O)(CC)CC)(OCC(F)(F)C(F)(F)F)=O