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

*Links on SpectraBase are not permalinks.

Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-acetylphenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-acetylphenyl ester
SpectraBase Compound ID 4e13K3GCudQ
InChI InChI=1S/C18H16F8O5/c1-10(27)11-5-7-12(8-6-11)31-14(29)4-2-3-13(28)30-9-16(21,22)18(25,26)17(23,24)15(19)20/h5-8,15H,2-4,9H2,1H3
InChIKey OSPWJLINCCDNPD-UHFFFAOYSA-N
Mol Weight 464.31 g/mol
Molecular Formula C18H16F8O5
Exact Mass 464.086999 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 JI5n2q1BF6x
Name Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 4-acetylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.086998914 u
Formula C18H16F8O5
InChI InChI=1S/C18H16F8O5/c1-10(27)11-5-7-12(8-6-11)31-14(29)4-2-3-13(28)30-9-16(21,22)18(25,26)17(23,24)15(19)20/h5-8,15H,2-4,9H2,1H3
InChIKey OSPWJLINCCDNPD-UHFFFAOYSA-N
Molecular Weight 464.308 g/mol
SMILES C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OC1=CC=C(C(C)=O)C=C1)=O