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1-Phenyl-3-(4-chlorophenyl)-3A,8B-dihydro-4H-indeno[1,2-C]pyrazole
SpectraBase Compound ID GfDNjY4uQkg
InChI InChI=1S/C22H17ClN2/c23-17-12-10-15(11-13-17)21-20-14-16-6-4-5-9-19(16)22(20)25(24-21)18-7-2-1-3-8-18/h1-13,20,22H,14H2
InChIKey ZKZHFQZAAWGJTR-UHFFFAOYSA-N
Mol Weight 344.85 g/mol
Molecular Formula C22H17ClN2
Exact Mass 344.108026 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FforSWsPPl6
Name 1-Phenyl-3-(4-chlorophenyl)-3A,8B-dihydro-4H-indeno[1,2-C]pyrazole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.108026255 u
Formula C22H17ClN2
InChI InChI=1S/C22H17ClN2/c23-17-12-10-15(11-13-17)21-20-14-16-6-4-5-9-19(16)22(20)25(24-21)18-7-2-1-3-8-18/h1-13,20,22H,14H2
InChIKey ZKZHFQZAAWGJTR-UHFFFAOYSA-N
Molecular Weight 344.845 g/mol
SMILES C12=CC=CC=C2CC2C1N(C1=CC=CC=C1)N=C2C1=CC=C(C=C1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90689