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3-(p-Chlorophenyl)-3-phenylphthalide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

3-(p-Chlorophenyl)-3-phenylphthalide
SpectraBase Compound ID 97WBZ9ZUrNR
InChI InChI=1S/C20H13ClO2/c21-16-12-10-15(11-13-16)20(14-6-2-1-3-7-14)18-9-5-4-8-17(18)19(22)23-20/h1-13H
InChIKey UGPXADOQIWJDGS-UHFFFAOYSA-N
Mol Weight 320.78 g/mol
Molecular Formula C20H13ClO2
Exact Mass 320.060407 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID K9gdeDcsMhf
Name 3-(p-Chlorophenyl)-3-phenylphthalide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.060407357 u
Formula C20H13ClO2
InChI InChI=1S/C20H13ClO2/c21-16-12-10-15(11-13-16)20(14-6-2-1-3-7-14)18-9-5-4-8-17(18)19(22)23-20/h1-13H
InChIKey UGPXADOQIWJDGS-UHFFFAOYSA-N
Molecular Weight 320.775 g/mol
SMILES C=12C=CC=CC1C(OC2(C=1C=CC(=CC1)Cl)C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Raman) 0.955099