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5-Chloro-2-hydroxy-4-methylbenzophenone, pentafluoropropionate
SpectraBase Compound ID CtmJ06G5fvc
InChI InChI=1S/C17H10ClF5O3/c1-9-7-13(26-15(25)16(19,20)17(21,22)23)11(8-12(9)18)14(24)10-5-3-2-4-6-10/h2-8H,1H3
InChIKey WJVDBGOPXDQGON-UHFFFAOYSA-N
Mol Weight 392.71 g/mol
Molecular Formula C17H10ClF5O3
Exact Mass 392.023863 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EyDfgipo4lP
Name 5-Chloro-2-hydroxy-4-methylbenzophenone, pentafluoropropionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.023862694 u
Formula C17H10ClF5O3
InChI InChI=1S/C17H10ClF5O3/c1-9-7-13(26-15(25)16(19,20)17(21,22)23)11(8-12(9)18)14(24)10-5-3-2-4-6-10/h2-8H,1H3
InChIKey WJVDBGOPXDQGON-UHFFFAOYSA-N
Molecular Weight 392.709 g/mol
SMILES C1(Cl)=C(C=C(C(=C1)C(=O)C1=CC=CC=C1)OC(C(C(F)(F)F)(F)F)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954921