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3-Carbamoyl-1-p-tolyl-1H-pyrimido[1,2-a]pyrimidine-2,6-di-one
SpectraBase Compound ID CFodRdiHi3f
InChI InChI=1S/C15H12N4O3/c1-9-2-4-10(5-3-9)19-14(22)11(13(16)21)8-18-12(20)6-7-17-15(18)19/h2-8H,1H3,(H2,16,21)
InChIKey RONBRWADHJLPNB-UHFFFAOYSA-N
Mol Weight 296.29 g/mol
Molecular Formula C15H12N4O3
Exact Mass 296.09094 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Amde3Ww247Z
Name 3-Carbamoyl-1-p-tolyl-1H-pyrimido[1,2-A]pyrimidine-2,6-di-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.090940259 u
Formula C15H12N4O3
InChI InChI=1S/C15H12N4O3/c1-9-2-4-10(5-3-9)19-14(22)11(13(16)21)8-18-12(20)6-7-17-15(18)19/h2-8H,1H3,(H2,16,21)
InChIKey RONBRWADHJLPNB-UHFFFAOYSA-N
Molecular Weight 296.286 g/mol
SMILES C=12N(C=C(C(N2C=2C=CC(=CC2)C)=O)C(=O)N)C(=O)C=CN1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.91928