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3-(Trifluoromethoxy)thiophenol, S-pentafluoropropionyl-

View entire compound with spectra: 1 FTIR

3-(Trifluoromethoxy)thiophenol, S-pentafluoropropionyl-
SpectraBase Compound ID DOUyyY10Rjm
InChI InChI=1S/C10H4F8O2S/c11-8(12,9(13,14)15)7(19)21-6-3-1-2-5(4-6)20-10(16,17)18/h1-4H
InChIKey RSRJUBSLAKQFFD-UHFFFAOYSA-N
Mol Weight 340.19 g/mol
Molecular Formula C10H4F8O2S
Exact Mass 339.980426 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 62IPfI3mAhI
Name 3-(Trifluoromethoxy)thiophenol, S-pentafluoropropionyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.980425845 u
Formula C10H4F8O2S
InChI InChI=1S/C10H4F8O2S/c11-8(12,9(13,14)15)7(19)21-6-3-1-2-5(4-6)20-10(16,17)18/h1-4H
InChIKey RSRJUBSLAKQFFD-UHFFFAOYSA-N
Molecular Weight 340.187 g/mol
SMILES C(OC1=CC(SC(C(C(F)(F)F)(F)F)=O)=CC=C1)(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867299