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

*Links on SpectraBase are not permalinks.

Ethane-1,2-diyl bis(2,3,4,5,6-pentafluorobenzoate)

View entire compound with spectra: 1 NMR

Ethane-1,2-diyl bis(2,3,4,5,6-pentafluorobenzoate)
SpectraBase Compound ID HVi65U3dsvV
InChI InChI=1S/C16H4F10O4/c17-5-3(6(18)10(22)13(25)9(5)21)15(27)29-1-2-30-16(28)4-7(19)11(23)14(26)12(24)8(4)20/h1-2H2
InChIKey CLENQEKBQNRCIV-UHFFFAOYSA-N
Mol Weight 450.19 g/mol
Molecular Formula C16H4F10O4
Exact Mass 449.99499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID 6BWn2DKBh0c
Name Ethane-1,2-diyl bis(2,3,4,5,6-pentafluorobenzoate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 449.994990235 u
Formula C16H4F10O4
InChI InChI=1S/C16H4F10O4/c17-5-3(6(18)10(22)13(25)9(5)21)15(27)29-1-2-30-16(28)4-7(19)11(23)14(26)12(24)8(4)20/h1-2H2
InChIKey CLENQEKBQNRCIV-UHFFFAOYSA-N
Molecular Weight 450.188 g/mol
SMILES C(OC(C1=C(C(=C(C(=C1F)F)F)F)F)=O)COC(C1=C(C(=C(C(=C1F)F)F)F)F)=O