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

*Links on SpectraBase are not permalinks.
2,6-Dichloro-4-(perfluorohexyl)benzoic acid
SpectraBase Compound ID BXxBebyCq7x
InChI InChI=1S/C13H3Cl2F13O2/c14-4-1-3(2-5(15)6(4)7(29)30)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)28/h1-2H,(H,29,30)
InChIKey DCWMFFDTGVVTSB-UHFFFAOYSA-N
Mol Weight 509.05 g/mol
Molecular Formula C13H3Cl2F13O2
Exact Mass 507.930251 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 5rPWCyRo7P8
Name 2,6-Dichloro-4-(perfluorohexyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H3Cl2F13O2
InChI InChI=1S/C13H3Cl2F13O2/c14-4-1-3(2-5(15)6(4)7(29)30)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)28/h1-2H,(H,29,30)
InChIKey DCWMFFDTGVVTSB-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.tet.2015.12.026
Molecular Weight 509.050 g/mol
SMILES OC(c1c(cc(cc1Cl)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl)=O
SPLASH splash10-000l-0090120000-add3a099c162310cf836
Source of Spectrum F-72-724-9a
Wiley ID 1806025