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

*Links on SpectraBase are not permalinks.

Undecanoic acid, 2,2,2- trifluoroethyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Undecanoic acid, 2,2,2- trifluoroethyl ester
SpectraBase Compound ID 4y3CJ60qYxP
InChI InChI=1S/C13H23F3O2/c1-2-3-4-5-6-7-8-9-10-12(17)18-11-13(14,15)16/h2-11H2,1H3
InChIKey MWHMWUVGAHYNNK-UHFFFAOYSA-N
Mol Weight 268.32 g/mol
Molecular Formula C13H23F3O2
Exact Mass 268.165014 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID JJTcU13mgCT
Name Undecanoic acid, 2,2,2- trifluoroethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.165014468 u
Formula C13H23F3O2
InChI InChI=1S/C13H23F3O2/c1-2-3-4-5-6-7-8-9-10-12(17)18-11-13(14,15)16/h2-11H2,1H3
InChIKey MWHMWUVGAHYNNK-UHFFFAOYSA-N
Molecular Weight 268.320 g/mol
SMILES C(CCCCCCC(=O)OCC(F)(F)F)CCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.911801