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2,2-Difluoro-3-phenyl-3-(phenylthio)propane
SpectraBase Compound ID AetGqvXOVy7
InChI InChI=1S/C15H14F2S/c1-15(16,17)14(12-8-4-2-5-9-12)18-13-10-6-3-7-11-13/h2-11,14H,1H3
InChIKey VHBJKWOQXDBQLY-UHFFFAOYSA-N
Mol Weight 264.33 g/mol
Molecular Formula C15H14F2S
Exact Mass 264.078428 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6LN4CXfXjiz
Name 2,2-Difluoro-3-phenyl-3-(phenylthio)propane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.078427951 u
Formula C15H14F2S
InChI InChI=1S/C15H14F2S/c1-15(16,17)14(12-8-4-2-5-9-12)18-13-10-6-3-7-11-13/h2-11,14H,1H3
InChIKey VHBJKWOQXDBQLY-UHFFFAOYSA-N
Molecular Weight 264.334 g/mol
SMILES C(C(SC1=CC=CC=C1)C=1C=CC=CC1)(F)(F)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.807432