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[(1E,3E)-5,5,5-trifluoropenta-1,3-dienyl]benzene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

[(1E,3E)-5,5,5-trifluoropenta-1,3-dienyl]benzene
SpectraBase Compound ID 92Q2eyj3Aip
InChI InChI=1S/C11H9F3/c12-11(13,14)9-5-4-8-10-6-2-1-3-7-10/h1-9H/b8-4+,9-5+
InChIKey KWLXSWLOZGXCJK-KBXRYBNXSA-N
Mol Weight 198.19 g/mol
Molecular Formula C11H9F3
Exact Mass 198.065635 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CTNKjip7ome
Name [(1E,3E)-5,5,5-Trifluoropenta-1,3-dienyl]benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 198.065634779 u
Formula C11H9F3
InChI InChI=1S/C11H9F3/c12-11(13,14)9-5-4-8-10-6-2-1-3-7-10/h1-9H/b8-4+,9-5+
InChIKey KWLXSWLOZGXCJK-KBXRYBNXSA-N
Molecular Weight 198.188 g/mol
SMILES C(\C=C\C=C\C1=CC=CC=C1)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902527