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4-Hydroxy-3-chlorobiphenyl, pentafluoropropionate

View entire compound with spectra: 1 FTIR

4-Hydroxy-3-chlorobiphenyl, pentafluoropropionate
SpectraBase Compound ID 4P7iNLfDkQl
InChI InChI=1S/C15H8ClF5O2/c16-11-8-10(9-4-2-1-3-5-9)6-7-12(11)23-13(22)14(17,18)15(19,20)21/h1-8H
InChIKey LGCVAZIPXPWDCS-UHFFFAOYSA-N
Mol Weight 350.67 g/mol
Molecular Formula C15H8ClF5O2
Exact Mass 350.013298 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2XQyJkVdKQN
Name 4-Hydroxy-3-chlorobiphenyl, pentafluoropropionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.013298011 u
Formula C15H8ClF5O2
InChI InChI=1S/C15H8ClF5O2/c16-11-8-10(9-4-2-1-3-5-9)6-7-12(11)23-13(22)14(17,18)15(19,20)21/h1-8H
InChIKey LGCVAZIPXPWDCS-UHFFFAOYSA-N
Molecular Weight 350.672 g/mol
SMILES C1(C2=CC=CC=C2)=CC(=C(C=C1)OC(C(C(F)(F)F)(F)F)=O)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.839334