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2-(Diphenylmethyl)-3-methylpyrido[1,2-a]pyrimidin-4-one
SpectraBase Compound ID EQgMxDIIFC8
InChI InChI=1S/C22H18N2O/c1-16-21(23-19-14-8-9-15-24(19)22(16)25)20(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-15,20H,1H3
InChIKey NJQXKYYKDDWRRD-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 53N9W3qvz7H
Name 2-(Diphenylmethyl)-3-methylpyrido[1,2-A]pyrimidin-4-one
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/c1-16-21(23-19-14-8-9-15-24(19)22(16)25)20(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-15,20H,1H3
InChIKey NJQXKYYKDDWRRD-UHFFFAOYSA-N
Molecular Weight 326.399 g/mol
SMILES C1(=C(C(=O)N2C(=N1)C=CC=C2)C)C(C1=CC=CC=C1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.940769