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

*Links on SpectraBase are not permalinks.

1,2-Benzenediol, o-phenylacetyl-o'-pentadecafluorooctanoyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

1,2-Benzenediol, o-phenylacetyl-o'-pentadecafluorooctanoyl-
SpectraBase Compound ID s3B7SIrVrw
InChI InChI=1S/C22H11F15O4/c23-16(24,17(25,26)18(27,28)19(29,30)20(31,32)21(33,34)22(35,36)37)15(39)41-13-9-5-4-8-12(13)40-14(38)10-11-6-2-1-3-7-11/h1-9H,10H2
InChIKey PDSSACZUSLPLIP-UHFFFAOYSA-N
Mol Weight 624.3 g/mol
Molecular Formula C22H11F15O4
Exact Mass 624.041781 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 2O4pZbl74GL
Name 1,2-Benzenediol, o-phenylacetyl-o'-pentadecafluorooctanoyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 624.041781275 u
Formula C22H11F15O4
InChI InChI=1S/C22H11F15O4/c23-16(24,17(25,26)18(27,28)19(29,30)20(31,32)21(33,34)22(35,36)37)15(39)41-13-9-5-4-8-12(13)40-14(38)10-11-6-2-1-3-7-11/h1-9H,10H2
InChIKey PDSSACZUSLPLIP-UHFFFAOYSA-N
Molecular Weight 624.302 g/mol
SMILES C(OC1=CC=CC=C1OC(=O)C(C(C(C(C(F)(F)C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(=O)CC1=CC=CC=C1