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2-(3-Chloro-2-methylphenyl)-2,3-dihydro-1,4-phthalazinedione

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-(3-Chloro-2-methylphenyl)-2,3-dihydro-1,4-phthalazinedione
SpectraBase Compound ID Bbvrka6Zoun
InChI InChI=1S/C15H11ClN2O2/c1-9-12(16)7-4-8-13(9)18-15(20)11-6-3-2-5-10(11)14(19)17-18/h2-8H,1H3,(H,17,19)
InChIKey SYOLYGCKBUCFQT-UHFFFAOYSA-N
Mol Weight 286.72 g/mol
Molecular Formula C15H11ClN2O2
Exact Mass 286.050905 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Jol2R7fZOjV
Name 2-(3-Chloro-2-methyl-phenyl)-2,3-dihydro-phthalazine-1,4-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.050905300 u
Formula C15H11ClN2O2
InChI InChI=1S/C15H11ClN2O2/c1-9-12(16)7-4-8-13(9)18-15(20)11-6-3-2-5-10(11)14(19)17-18/h2-8H,1H3,(H,17,19)
InChIKey SYOLYGCKBUCFQT-UHFFFAOYSA-N
SMILES C1=CC2=C(C(N(C3=C(C(=CC=C3)Cl)C)NC2=O)=O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.88684