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Hexafluoroisofluoropropyl phenylacetate

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

Hexafluoroisofluoropropyl phenylacetate
SpectraBase Compound ID CkcsiMbeSPq
InChI InChI=1S/C11H8F6O2/c12-10(13,14)9(11(15,16)17)19-8(18)6-7-4-2-1-3-5-7/h1-5,9H,6H2
InChIKey RBGWMXWJGPQRKO-UHFFFAOYSA-N
Mol Weight 286.17 g/mol
Molecular Formula C11H8F6O2
Exact Mass 286.042848 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KcMPJanddts
Name Hexafluoroisofluoropropyl phenylacetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.042848474 u
Formula C11H8F6O2
InChI InChI=1S/C11H8F6O2/c12-10(13,14)9(11(15,16)17)19-8(18)6-7-4-2-1-3-5-7/h1-5,9H,6H2
InChIKey RBGWMXWJGPQRKO-UHFFFAOYSA-N
Molecular Weight 286.173 g/mol
SMILES C(C(F)(F)F)(C(F)(F)F)OC(=O)CC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.809303