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2-oxo-5-Benzyl-4,6-diphenyl-1,2-dihydropyrimidine
SpectraBase Compound ID B8ZktsRj31Q
InChI InChI=1S/C23H18N2O/c26-23-24-21(18-12-6-2-7-13-18)20(16-17-10-4-1-5-11-17)22(25-23)19-14-8-3-9-15-19/h1-15H,16H2,(H,24,25,26)
InChIKey LCAUMAAXBTWKNL-UHFFFAOYSA-N
Mol Weight 338.41 g/mol
Molecular Formula C23H18N2O
Exact Mass 338.141913 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4Rtu0pWNap0
Name 2-oxo-5-Benzyl-4,6-diphenyl-1,2-dihydropyrimidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.141913207 u
Formula C23H18N2O
InChI InChI=1S/C23H18N2O/c26-23-24-21(18-12-6-2-7-13-18)20(16-17-10-4-1-5-11-17)22(25-23)19-14-8-3-9-15-19/h1-15H,16H2,(H,24,25,26)
InChIKey LCAUMAAXBTWKNL-UHFFFAOYSA-N
Molecular Weight 338.410 g/mol
SMILES C1(=C(C(=NC(N1)=O)C1=CC=CC=C1)CC1=CC=CC=C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.887939