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

*Links on SpectraBase are not permalinks.

Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-chlorophenyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-chlorophenyl ester
SpectraBase Compound ID FdsAW2WwKAR
InChI InChI=1S/C15H11ClF8O4/c16-8-2-1-3-9(6-8)28-11(26)5-4-10(25)27-7-13(19,20)15(23,24)14(21,22)12(17)18/h1-3,6,12H,4-5,7H2
InChIKey DDNKKUKGBCGKPU-UHFFFAOYSA-N
Mol Weight 442.69 g/mol
Molecular Formula C15H11ClF8O4
Exact Mass 442.021812 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 I9srtg9lzWa
Name Succinic acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-chlorophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.021811834 u
Formula C15H11ClF8O4
InChI InChI=1S/C15H11ClF8O4/c16-8-2-1-3-9(6-8)28-11(26)5-4-10(25)27-7-13(19,20)15(23,24)14(21,22)12(17)18/h1-3,6,12H,4-5,7H2
InChIKey DDNKKUKGBCGKPU-UHFFFAOYSA-N
Molecular Weight 442.689 g/mol
SMILES C(CC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OC1=CC(=CC=C1)Cl)=O