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4-Bromo-4'-trifluoromethylbenzophenone

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

4-Bromo-4'-trifluoromethylbenzophenone
SpectraBase Compound ID I4J98H3zK8v
InChI InChI=1S/C14H8BrF3O/c15-12-7-3-10(4-8-12)13(19)9-1-5-11(6-2-9)14(16,17)18/h1-8H
InChIKey WBTNCOKTRQISPJ-UHFFFAOYSA-N
Mol Weight 329.12 g/mol
Molecular Formula C14H8BrF3O
Exact Mass 327.971062 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 48CKj9YLRgR
Name 4-Bromo-4'-trifluoromethylbenzophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.971062366 u
Formula C14H8BrF3O
InChI InChI=1S/C14H8BrF3O/c15-12-7-3-10(4-8-12)13(19)9-1-5-11(6-2-9)14(16,17)18/h1-8H
InChIKey WBTNCOKTRQISPJ-UHFFFAOYSA-N
Molecular Weight 329.116 g/mol
SMILES C(F)(F)(F)C1=CC=C(C=C1)C(=O)C=1C=CC(Br)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.860252