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2-oxo-3,4,6-Triphenyl-1,2,3,4-tetrahydropyrimidine

View entire compound with spectra: 1 NMR, and 1 FTIR

2-oxo-3,4,6-Triphenyl-1,2,3,4-tetrahydropyrimidine
SpectraBase Compound ID 1pswV3UUj33
InChI InChI=1S/C22H18N2O/c25-22-23-20(17-10-4-1-5-11-17)16-21(18-12-6-2-7-13-18)24(22)19-14-8-3-9-15-19/h1-16,21H,(H,23,25)
InChIKey JHAOWFQLUAXXSK-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C22H18N2O
Exact Mass 326.141913 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6MvCi6MYpKu
Name 2-oxo-3,4,6-Triphenyl-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 326.141913207 u
Formula C22H18N2O
InChI InChI=1S/C22H18N2O/c25-22-23-20(17-10-4-1-5-11-17)16-21(18-12-6-2-7-13-18)24(22)19-14-8-3-9-15-19/h1-16,21H,(H,23,25)
InChIKey JHAOWFQLUAXXSK-UHFFFAOYSA-N
Molecular Weight 326.399 g/mol
SMILES C1(=CC(N(C(N1)=O)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912666