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Thiophenol, S-heptafluorobutyryl-

View entire compound with spectra: 1 FTIR

Thiophenol, S-heptafluorobutyryl-
SpectraBase Compound ID B9u1RwInnHQ
InChI InChI=1S/C10H5F7OS/c11-8(12,9(13,14)10(15,16)17)7(18)19-6-4-2-1-3-5-6/h1-5H
InChIKey DNROBRSWMCUYGI-UHFFFAOYSA-N
Mol Weight 306.2 g/mol
Molecular Formula C10H5F7OS
Exact Mass 305.994933 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2DpOvNEO4C9
Name Thiophenol, S-heptafluorobutyryl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.994933095 u
Formula C10H5F7OS
InChI InChI=1S/C10H5F7OS/c11-8(12,9(13,14)10(15,16)17)7(18)19-6-4-2-1-3-5-6/h1-5H
InChIKey DNROBRSWMCUYGI-UHFFFAOYSA-N
Molecular Weight 306.198 g/mol
SMILES C1(SC(=O)C(C(C(F)(F)F)(F)F)(F)F)=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959546