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5-Benzyl-2-(4-chlorophenyl)-2,5-dihydro-3H-pyridazino[4,3-b]indol-3-one
SpectraBase Compound ID HraF0NmznH8
InChI InChI=1S/C23H16ClN3O/c24-17-10-12-18(13-11-17)27-22(28)14-21-23(25-27)19-8-4-5-9-20(19)26(21)15-16-6-2-1-3-7-16/h1-14H,15H2
InChIKey LGEWNPCBMRWIBD-UHFFFAOYSA-N
Mol Weight 385.85 g/mol
Molecular Formula C23H16ClN3O
Exact Mass 385.09819 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HZujWHQmMl9
Name 5-Benzyl-2-(4-chlorophenyl)-2,5-dihydro-3H-pyridazino[4,3-B]indol-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.098189846 u
Formula C23H16ClN3O
InChI InChI=1S/C23H16ClN3O/c24-17-10-12-18(13-11-17)27-22(28)14-21-23(25-27)19-8-4-5-9-20(19)26(21)15-16-6-2-1-3-7-16/h1-14H,15H2
InChIKey LGEWNPCBMRWIBD-UHFFFAOYSA-N
Molecular Weight 385.854 g/mol
SMILES C1=2C(=NN(C(C2)=O)C=2C=CC(=CC2)Cl)C=2C=CC=CC2N1CC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.853779