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 pentafluorobenzyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentafluorobenzyl ester
SpectraBase Compound ID 5fHJiBXnC1v
InChI InChI=1S/C17H11F13O4/c18-9-6(10(19)12(21)13(22)11(9)20)4-33-7(31)2-1-3-8(32)34-5-15(25,26)17(29,30)16(27,28)14(23)24/h14H,1-5H2
InChIKey LOPYOOLEBMINMX-UHFFFAOYSA-N
Mol Weight 526.25 g/mol
Molecular Formula C17H11F13O4
Exact Mass 526.044975 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 Jk6Xk2OFIuT
Name Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl pentafluorobenzyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 526.044974949 u
Formula C17H11F13O4
InChI InChI=1S/C17H11F13O4/c18-9-6(10(19)12(21)13(22)11(9)20)4-33-7(31)2-1-3-8(32)34-5-15(25,26)17(29,30)16(27,28)14(23)24/h14H,1-5H2
InChIKey LOPYOOLEBMINMX-UHFFFAOYSA-N
Molecular Weight 526.250 g/mol
SMILES C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OCC1=C(C(=C(C(=C1F)F)F)F)F)=O