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2,3,4-Trifluorophenol, heptafluorobutyrate

View entire compound with spectra: 1 FTIR

2,3,4-Trifluorophenol, heptafluorobutyrate
SpectraBase Compound ID 2f1YzgeZSHB
InChI InChI=1S/C10H2F10O2/c11-3-1-2-4(6(13)5(3)12)22-7(21)8(14,15)9(16,17)10(18,19)20/h1-2H
InChIKey RSKCYQOMTOEBGX-UHFFFAOYSA-N
Mol Weight 344.11 g/mol
Molecular Formula C10H2F10O2
Exact Mass 343.989511 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EadnkURARLF
Name 2,3,4-Trifluorophenol, heptafluorobutyrate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.989510932 u
Formula C10H2F10O2
InChI InChI=1S/C10H2F10O2/c11-3-1-2-4(6(13)5(3)12)22-7(21)8(14,15)9(16,17)10(18,19)20/h1-2H
InChIKey RSKCYQOMTOEBGX-UHFFFAOYSA-N
Molecular Weight 344.108 g/mol
SMILES C1(=C(C(=CC=C1OC(=O)C(C(C(F)(F)F)(F)F)(F)F)F)F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.901045