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2,6-Dimethyl-4-benzoyl-3H-imidazo[1,5-B]pyridazine-5,7-dione
SpectraBase Compound ID 44NeGJNijHB
InChI InChI=1S/C15H13N3O3/c1-9-8-11(13(19)10-6-4-3-5-7-10)12-14(20)17(2)15(21)18(12)16-9/h3-7H,8H2,1-2H3
InChIKey NSTJZEWLEMIAIY-UHFFFAOYSA-N
Mol Weight 283.29 g/mol
Molecular Formula C15H13N3O3
Exact Mass 283.095691 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 79nOipRZnI7
Name 2,6-Dimethyl-4-benzoyl-3H-imidazo[1,5-B]pyridazine-5,7-dione
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 283.095691288 u
Formula C15H13N3O3
InChI InChI=1S/C15H13N3O3/c1-9-8-11(13(19)10-6-4-3-5-7-10)12-14(20)17(2)15(21)18(12)16-9/h3-7H,8H2,1-2H3
InChIKey NSTJZEWLEMIAIY-UHFFFAOYSA-N
Molecular Weight 283.287 g/mol
SMILES C1C(=NN2C(=C1C(=O)C1=CC=CC=C1)C(=O)N(C2=O)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964927