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Trans-1,1,1-trifluoro-4-phenyl-3-buten-2-ol

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

Trans-1,1,1-trifluoro-4-phenyl-3-buten-2-ol
SpectraBase Compound ID xiCYfVGFPI
InChI InChI=1S/C11H11F3O/c1-10(15,11(12,13)14)8-7-9-5-3-2-4-6-9/h2-8,15H,1H3/b8-7+
InChIKey CLRVQZYMDAOWKZ-BQYQJAHWSA-N
Mol Weight 216.2 g/mol
Molecular Formula C11H11F3O
Exact Mass 216.076199 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FdFsFRuxnCL
Name Trans-1,1,1-trifluoro-4-phenyl-3-buten-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.076199462 u
Formula C11H11F3O
InChI InChI=1S/C11H11F3O/c1-10(15,11(12,13)14)8-7-9-5-3-2-4-6-9/h2-8,15H,1H3/b8-7+
InChIKey CLRVQZYMDAOWKZ-BQYQJAHWSA-N
Molecular Weight 216.203 g/mol
SMILES C(F)(C(\C=C\C1=CC=CC=C1)(C)O)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93383