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5,5,10-trichloro-5H-dibenzo[a,d][7]annulene
SpectraBase Compound ID 7WdFSGf7oYv
InChI InChI=1S/C15H9Cl3/c16-14-9-10-5-1-3-7-12(10)15(17,18)13-8-4-2-6-11(13)14/h1-9H
InChIKey NSEGFMPFNSPECG-UHFFFAOYSA-N
Mol Weight 295.6 g/mol
Molecular Formula C15H9Cl3
Exact Mass 293.976983 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2GUKXHebrsv
Name 5,5,10-Trichloro-5H-dibenzo[A,D][7]annulene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 293.976983390 u
Formula C15H9Cl3
InChI InChI=1S/C15H9Cl3/c16-14-9-10-5-1-3-7-12(10)15(17,18)13-8-4-2-6-11(13)14/h1-9H
InChIKey NSEGFMPFNSPECG-UHFFFAOYSA-N
Molecular Weight 295.596 g/mol
SMILES C1(Cl)=CC2=CC=CC=C2C(Cl)(Cl)C2=CC=CC=C12
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956659