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1-Allyl-4-benzoyl-3H-pyridine-2,6-dione

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

1-Allyl-4-benzoyl-3H-pyridine-2,6-dione
SpectraBase Compound ID DPAScgoMwuT
InChI InChI=1S/C15H13NO3/c1-2-8-16-13(17)9-12(10-14(16)18)15(19)11-6-4-3-5-7-11/h2-7,9H,1,8,10H2
InChIKey GKLJFHSJOGTGKN-UHFFFAOYSA-N
Mol Weight 255.27 g/mol
Molecular Formula C15H13NO3
Exact Mass 255.089543 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 61vw0DkUfiy
Name 1-Allyl-4-benzoyl-3H-pyridine-2,6-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 255.089543280 u
Formula C15H13NO3
InChI InChI=1S/C15H13NO3/c1-2-8-16-13(17)9-12(10-14(16)18)15(19)11-6-4-3-5-7-11/h2-7,9H,1,8,10H2
InChIKey GKLJFHSJOGTGKN-UHFFFAOYSA-N
Molecular Weight 255.273 g/mol
SMILES C1(CC(=CC(N1CC=C)=O)C(C=1C=CC=CC1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.832467