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5-Acetyl-4-hydroxy-1-(4-methoxy-phenyl)-6-methyl-3-phenyl-2(1H)-pyridinone
SpectraBase Compound ID ButLEuRaq06
InChI InChI=1S/C21H19NO4/c1-13-18(14(2)23)20(24)19(15-7-5-4-6-8-15)21(25)22(13)16-9-11-17(26-3)12-10-16/h4-12,24H,1-3H3
InChIKey OQMXQMLFCKKIQY-UHFFFAOYSA-N
Mol Weight 349.39 g/mol
Molecular Formula C21H19NO4
Exact Mass 349.131408 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JMbG4WGg9DG
Name 5-Acetyl-4-hydroxy-1-(4-methoxy-phenyl)-6-methyl-3-phenyl-2(1H)-pyridinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.131408092 u
Formula C21H19NO4
InChI InChI=1S/C21H19NO4/c1-13-18(14(2)23)20(24)19(15-7-5-4-6-8-15)21(25)22(13)16-9-11-17(26-3)12-10-16/h4-12,24H,1-3H3
InChIKey OQMXQMLFCKKIQY-UHFFFAOYSA-N
Molecular Weight 349.386 g/mol
SMILES C=1(C(N(C2=CC=C(C=C2)OC)C(=C(C1O)C(=O)C)C)=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.884791