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4-Chloro-3-(trifluoromethylthio)benzyl bromide

View entire compound with spectra: 1 FTIR

4-Chloro-3-(trifluoromethylthio)benzyl bromide
SpectraBase Compound ID Ij11sGPbM6t
InChI InChI=1S/C8H5BrClF3S/c9-4-5-1-2-6(10)7(3-5)14-8(11,12)13/h1-3H,4H2
InChIKey QRIMMRPSWRLACM-UHFFFAOYSA-N
Mol Weight 305.54 g/mol
Molecular Formula C8H5BrClF3S
Exact Mass 303.893597 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CbcllhqyP35
Name 4-Chloro-3-(trifluoromethylthio)benzyl bromide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.893596524 u
Formula C8H5BrClF3S
InChI InChI=1S/C8H5BrClF3S/c9-4-5-1-2-6(10)7(3-5)14-8(11,12)13/h1-3H,4H2
InChIKey QRIMMRPSWRLACM-UHFFFAOYSA-N
Molecular Weight 305.540 g/mol
SMILES C(F)(F)(F)SC1=C(C=CC(=C1)CBr)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.916899