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4-Benzyl-1,2-dihydro-2-methyl-1-oxophthalazine

View entire compound with spectra: 1 NMR, and 1 FTIR

4-Benzyl-1,2-dihydro-2-methyl-1-oxophthalazine
SpectraBase Compound ID 7ApEK1XFfm7
InChI InChI=1S/C16H14N2O/c1-18-16(19)14-10-6-5-9-13(14)15(17-18)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChIKey KUTSOIMAOFABLX-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C16H14N2O
Exact Mass 250.110613 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4SHvSZBvopi
Name 4-Benzyl-1,2-dihydro-2-methyl-1-oxophthalazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.110613078 u
Formula C16H14N2O
InChI InChI=1S/C16H14N2O/c1-18-16(19)14-10-6-5-9-13(14)15(17-18)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChIKey KUTSOIMAOFABLX-UHFFFAOYSA-N
Molecular Weight 250.301 g/mol
SMILES C12=C(C(N(N=C2CC2=CC=CC=C2)C)=O)C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.822992