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4-(3-Chloro-5-fluorophenyl)phenol, acetate

View entire compound with spectra: 1 FTIR

4-(3-Chloro-5-fluorophenyl)phenol, acetate
SpectraBase Compound ID 6ItSu5hJ0q5
InChI InChI=1S/C14H10ClFO2/c1-9(17)18-14-4-2-10(3-5-14)11-6-12(15)8-13(16)7-11/h2-8H,1H3
InChIKey ZPHPXMSTDBWRRF-UHFFFAOYSA-N
Mol Weight 264.68 g/mol
Molecular Formula C14H10ClFO2
Exact Mass 264.035335 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HlKWFwopkJi
Name 4-(3-Chloro-5-fluorophenyl)phenol, acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.035335423 u
Formula C14H10ClFO2
InChI InChI=1S/C14H10ClFO2/c1-9(17)18-14-4-2-10(3-5-14)11-6-12(15)8-13(16)7-11/h2-8H,1H3
InChIKey ZPHPXMSTDBWRRF-UHFFFAOYSA-N
Molecular Weight 264.683 g/mol
SMILES C1(=CC=C(C=C1)OC(C)=O)C1=CC(=CC(=C1)F)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.923502