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2-Oxo-4,6-diphenyl-3-(4-tolyl)-1,2,3,4-tetrahydropyrimidine

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

2-Oxo-4,6-diphenyl-3-(4-tolyl)-1,2,3,4-tetrahydropyrimidine
SpectraBase Compound ID 9FbQD3HTk7d
InChI InChI=1S/C23H20N2O/c1-17-12-14-20(15-13-17)25-22(19-10-6-3-7-11-19)16-21(24-23(25)26)18-8-4-2-5-9-18/h2-16,22H,1H3,(H,24,26)
InChIKey PDQSBWSUMQXZEJ-UHFFFAOYSA-N
Mol Weight 340.43 g/mol
Molecular Formula C23H20N2O
Exact Mass 340.157563 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7t54OQ0s2lh
Name 2-oxo-4,6-Diphenyl-3-(4-tolyl)-1,2,3,4-tetrahydropyrimidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.157563271 u
Formula C23H20N2O
InChI InChI=1S/C23H20N2O/c1-17-12-14-20(15-13-17)25-22(19-10-6-3-7-11-19)16-21(24-23(25)26)18-8-4-2-5-9-18/h2-16,22H,1H3,(H,24,26)
InChIKey PDQSBWSUMQXZEJ-UHFFFAOYSA-N
Molecular Weight 340.426 g/mol
SMILES C1(N(C(C=C(N1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=C(C=C1)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91751