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2-(p-Tolysulfinyl)benzophenone

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

2-(p-Tolysulfinyl)benzophenone
SpectraBase Compound ID J7g0B9AD38B
InChI InChI=1S/C20H16O2S/c1-15-11-13-17(14-12-15)23(22)19-10-6-5-9-18(19)20(21)16-7-3-2-4-8-16/h2-14H,1H3
InChIKey TZLHCRKRKSEKMY-UHFFFAOYSA-N
Mol Weight 320.41 g/mol
Molecular Formula C20H16O2S
Exact Mass 320.087101 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JdWDR805wkP
Name 2-(p-Tolysulfinyl)benzophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.087100927 u
Formula C20H16O2S
InChI InChI=1S/C20H16O2S/c1-15-11-13-17(14-12-15)23(22)19-10-6-5-9-18(19)20(21)16-7-3-2-4-8-16/h2-14H,1H3
InChIKey TZLHCRKRKSEKMY-UHFFFAOYSA-N
Molecular Weight 320.406 g/mol
SMILES C1(S(C2=CC=C(C=C2)C)=O)=C(C(=O)C2=CC=CC=C2)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.804346