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3-Benzoyl-5-hydroxyflavone

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

3-Benzoyl-5-hydroxyflavone
SpectraBase Compound ID KaGpzmAfcew
InChI InChI=1S/C22H14O4/c23-16-12-7-13-17-18(16)21(25)19(20(24)14-8-3-1-4-9-14)22(26-17)15-10-5-2-6-11-15/h1-13,23H
InChIKey IDCWYWHOWNUUJW-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C22H14O4
Exact Mass 342.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 406Vqa8Awrt
Name 3-Benzoyl-5-hydroxyflavone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 342.089208927 u
Formula C22H14O4
InChI InChI=1S/C22H14O4/c23-16-12-7-13-17-18(16)21(25)19(20(24)14-8-3-1-4-9-14)22(26-17)15-10-5-2-6-11-15/h1-13,23H
InChIKey IDCWYWHOWNUUJW-UHFFFAOYSA-N
Molecular Weight 342.350 g/mol
SMILES C1=CC=CC=C1C(=O)C=1C(=O)C=2C(O)=CC=CC2OC1C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.85494