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4H-1-Benzopyran-4-one, 2,3-dibenzoyl-

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

4H-1-Benzopyran-4-one, 2,3-dibenzoyl-
SpectraBase Compound ID 6cbNw0695cR
InChI InChI=1S/C23H14O4/c24-20(15-9-3-1-4-10-15)19-22(26)17-13-7-8-14-18(17)27-23(19)21(25)16-11-5-2-6-12-16/h1-14H
InChIKey WKISLVVWJSPDSS-UHFFFAOYSA-N
Mol Weight 354.36 g/mol
Molecular Formula C23H14O4
Exact Mass 354.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FwiInygLiME
Name 4H-1-Benzopyran-4-one, 2,3-dibenzoyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.089208927 u
Formula C23H14O4
InChI InChI=1S/C23H14O4/c24-20(15-9-3-1-4-10-15)19-22(26)17-13-7-8-14-18(17)27-23(19)21(25)16-11-5-2-6-12-16/h1-14H
InChIKey WKISLVVWJSPDSS-UHFFFAOYSA-N
Molecular Weight 354.361 g/mol
SMILES C1(=C(OC=2C(C1=O)=CC=CC2)C(=O)C=1C=CC=CC1)C(=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961536