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1-Chloro-1,2-diphenylethyl phenyl sulfoxide

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1-Chloro-1,2-diphenylethyl phenyl sulfoxide
SpectraBase Compound ID 2UAY1MEbqBJ
InChI InChI=1S/C20H17ClOS/c21-20(18-12-6-2-7-13-18,16-17-10-4-1-5-11-17)23(22)19-14-8-3-9-15-19/h1-15H,16H2
InChIKey LRDPPMNMNGIGIF-UHFFFAOYSA-N
Mol Weight 340.87 g/mol
Molecular Formula C20H17ClOS
Exact Mass 340.068864 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9QOPat1Bc9v
Name 1-Chloro-1,2-diphenylethyl phenyl sulfoxide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.068864040 u
Formula C20H17ClOS
InChI InChI=1S/C20H17ClOS/c21-20(18-12-6-2-7-13-18,16-17-10-4-1-5-11-17)23(22)19-14-8-3-9-15-19/h1-15H,16H2
InChIKey LRDPPMNMNGIGIF-UHFFFAOYSA-N
Molecular Weight 340.868 g/mol
SMILES C=1(S(=O)C(CC=2C=CC=CC2)(C=2C=CC=CC2)Cl)C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960976