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Benzenemethanol, .alpha.-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)-

View entire compound with spectra: 1 FTIR

Benzenemethanol, .alpha.-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)-
SpectraBase Compound ID IS5KcT4Ex7L
InChI InChI=1S/C12H9F9O/c13-9(14,6-8(22)7-4-2-1-3-5-7)10(15,16)11(17,18)12(19,20)21/h1-5,8,22H,6H2
InChIKey ICQUUJWNIFSJKP-UHFFFAOYSA-N
Mol Weight 340.19 g/mol
Molecular Formula C12H9F9O
Exact Mass 340.050968 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AybFNBc98qF
Name Benzenemethanol, .alpha.-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.050968376 u
Formula C12H9F9O
InChI InChI=1S/C12H9F9O/c13-9(14,6-8(22)7-4-2-1-3-5-7)10(15,16)11(17,18)12(19,20)21/h1-5,8,22H,6H2
InChIKey ICQUUJWNIFSJKP-UHFFFAOYSA-N
Molecular Weight 340.189 g/mol
SMILES C(C(C(C(CC(O)C1=CC=CC=C1)(F)F)(F)F)(F)F)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917595