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3-Acetyl-2,6-dimethyl-4H-pyrido[1,2-a]pyrimidin-4-one
SpectraBase Compound ID 6cBrUn92jle
InChI InChI=1S/C12H12N2O2/c1-7-5-4-6-10-13-8(2)11(9(3)15)12(16)14(7)10/h4-6H,1-3H3
InChIKey UEHNVVRSHGEEGR-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C12H12N2O2
Exact Mass 216.089878 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6FMTOkSnNFB
Name 3-Acetyl-2,6-dimethyl-4H-pyrido[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 216.089877632 u
Formula C12H12N2O2
InChI InChI=1S/C12H12N2O2/c1-7-5-4-6-10-13-8(2)11(9(3)15)12(16)14(7)10/h4-6H,1-3H3
InChIKey UEHNVVRSHGEEGR-UHFFFAOYSA-N
Molecular Weight 216.240 g/mol
SMILES C1(N2C(=NC(=C1C(=O)C)C)C=CC=C2C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.98353