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1-(2,4-Dimethoxyphenyl)-3-phenyl-1,3-propanedione

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

1-(2,4-Dimethoxyphenyl)-3-phenyl-1,3-propanedione
SpectraBase Compound ID DEVLJ72lIl0
InChI InChI=1S/C17H16O4/c1-20-13-8-9-14(17(10-13)21-2)16(19)11-15(18)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
InChIKey AEEAKBXAXKZQPA-UHFFFAOYSA-N
Mol Weight 284.31 g/mol
Molecular Formula C17H16O4
Exact Mass 284.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FfI9jjRl5SU
Name 1-(2,4-Dimethoxyphenyl)-3-phenyl-1,3-propanedione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.104858991 u
Formula C17H16O4
InChI InChI=1S/C17H16O4/c1-20-13-8-9-14(17(10-13)21-2)16(19)11-15(18)12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
InChIKey AEEAKBXAXKZQPA-UHFFFAOYSA-N
SMILES C(CC(=O)C=1C=CC=CC1)(=O)C=1C(=CC(=CC1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.951603