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3-Methoxyphenol, pentafluoropropionate

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

3-Methoxyphenol, pentafluoropropionate
SpectraBase Compound ID K6jBp6XS5ER
InChI InChI=1S/C10H7F5O3/c1-17-6-3-2-4-7(5-6)18-8(16)9(11,12)10(13,14)15/h2-5H,1H3
InChIKey JLEYZJYPNVDZEN-UHFFFAOYSA-N
Mol Weight 270.16 g/mol
Molecular Formula C10H7F5O3
Exact Mass 270.031535 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Eu0Gn3A7oV4
Name 3-Methoxyphenol, pentafluoropropionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.031534897 u
Formula C10H7F5O3
InChI InChI=1S/C10H7F5O3/c1-17-6-3-2-4-7(5-6)18-8(16)9(11,12)10(13,14)15/h2-5H,1H3
InChIKey JLEYZJYPNVDZEN-UHFFFAOYSA-N
Molecular Weight 270.155 g/mol
SMILES C1=C(OC(C(C(F)(F)F)(F)F)=O)C=CC=C1OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.801082