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3-Allyl-1-phenyl-5-oxo-chromano-[2,3-B]-dihydro-2(1H)-pyridone
SpectraBase Compound ID 1BxvkmuMmQw
InChI InChI=1S/C21H15NO3/c1-2-8-14-13-17-19(23)16-11-6-7-12-18(16)25-21(17)22(20(14)24)15-9-4-3-5-10-15/h2-7,9-13H,1,8H2
InChIKey KPLZYZZPTIBZBF-UHFFFAOYSA-N
Mol Weight 329.36 g/mol
Molecular Formula C21H15NO3
Exact Mass 329.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3ocU05jqBJX
Name 3-Allyl-1-phenyl-5-oxo-chromano-[2,3-B]-dihydro-2(1H)-pyridone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.105193344 u
Formula C21H15NO3
InChI InChI=1S/C21H15NO3/c1-2-8-14-13-17-19(23)16-11-6-7-12-18(16)25-21(17)22(20(14)24)15-9-4-3-5-10-15/h2-7,9-13H,1,8H2
InChIKey KPLZYZZPTIBZBF-UHFFFAOYSA-N
Molecular Weight 329.355 g/mol
SMILES C1(=O)C(=CC=2C(=O)C3=CC=CC=C3OC2N1C1=CC=CC=C1)CC=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913095