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2-Methoxydiftalone
SpectraBase Compound ID GrKq0JEs5yJ
InChI InChI=1S/C17H14N2O3/c1-22-13-6-7-15-12(8-13)10-19-16(20)14-5-3-2-4-11(14)9-18(19)17(15)21/h2-8H,9-10H2,1H3
InChIKey MDYOUKIODBEHIU-UHFFFAOYSA-N
Mol Weight 294.31 g/mol
Molecular Formula C17H14N2O3
Exact Mass 294.100442 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B8b2npctDps
Name 2-Methoxydiftalone
Comments Computed using SmartSpectra Model v1.42
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Exact Mass 294.100442316 u
Formula C17H14N2O3
InChI InChI=1S/C17H14N2O3/c1-22-13-6-7-15-12(8-13)10-19-16(20)14-5-3-2-4-11(14)9-18(19)17(15)21/h2-8H,9-10H2,1H3
InChIKey MDYOUKIODBEHIU-UHFFFAOYSA-N
Molecular Weight 294.310 g/mol
SMILES C12=C(CN3N(C2=O)CC=2C(C3=O)=CC=C(C2)OC)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.806936