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4-Chloro-2-methylphenol, o-pentafluoropropionyl-

View entire compound with spectra: 1 FTIR

4-Chloro-2-methylphenol, o-pentafluoropropionyl-
SpectraBase Compound ID 1Gemi0FTfe0
InChI InChI=1S/C10H6ClF5O2/c1-5-4-6(11)2-3-7(5)18-8(17)9(12,13)10(14,15)16/h2-4H,1H3
InChIKey JVKAZWMEXXLEFQ-UHFFFAOYSA-N
Mol Weight 288.6 g/mol
Molecular Formula C10H6ClF5O2
Exact Mass 287.997648 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GNi4URtjHQb
Name 4-Chloro-2-methylphenol, o-pentafluoropropionyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 287.997647946 u
Formula C10H6ClF5O2
InChI InChI=1S/C10H6ClF5O2/c1-5-4-6(11)2-3-7(5)18-8(17)9(12,13)10(14,15)16/h2-4H,1H3
InChIKey JVKAZWMEXXLEFQ-UHFFFAOYSA-N
Molecular Weight 288.601 g/mol
SMILES CC1=C(OC(C(C(F)(F)F)(F)F)=O)C=CC(=C1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.957758