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2,5-Dichlorophenyl p-tolyl sulfone

View entire compound with spectra: 1 FTIR, and 1 Raman

2,5-Dichlorophenyl p-tolyl sulfone
SpectraBase Compound ID CkRGJ63kAFJ
InChI InChI=1S/C13H10Cl2O2S/c1-9-2-5-11(6-3-9)18(16,17)13-8-10(14)4-7-12(13)15/h2-8H,1H3
InChIKey DHNGROZPPPEKOA-UHFFFAOYSA-N
Mol Weight 301.19 g/mol
Molecular Formula C13H10Cl2O2S
Exact Mass 299.977856 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID HerU6e0D2Qu
Name 2,5-Dichlorophenyl p-tolyl sulfone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.977856134 u
Formula C13H10Cl2O2S
InChI InChI=1S/C13H10Cl2O2S/c1-9-2-5-11(6-3-9)18(16,17)13-8-10(14)4-7-12(13)15/h2-8H,1H3
InChIKey DHNGROZPPPEKOA-UHFFFAOYSA-N
Molecular Weight 301.187 g/mol
SMILES CC1=CC=C(C=C1)S(C1=CC(=CC=C1Cl)Cl)(=O)=O
Spectrum/Structure Validation Score (Raman) 0.896907