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1,2-Dihydro-1,1,2,2-tetrachlorocyclobuta[1]phenanthrene
SpectraBase Compound ID KaBeLuZwps6
InChI InChI=1S/C16H8Cl4/c17-15(18)13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16(15,19)20/h1-8H
InChIKey HUCVOIPHJWEWNU-UHFFFAOYSA-N
Mol Weight 342.1 g/mol
Molecular Formula C16H8Cl4
Exact Mass 339.938011 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Bu9SSAaYsFJ
Name 1,2-Dihydro-1,1,2,2-tetrachlorocyclobuta[1]phenanthrene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.938011058 u
Formula C16H8Cl4
InChI InChI=1S/C16H8Cl4/c17-15(18)13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16(15,19)20/h1-8H
InChIKey HUCVOIPHJWEWNU-UHFFFAOYSA-N
Molecular Weight 342.052 g/mol
SMILES C=12C=CC=CC1C=1C=CC=CC1C=1C(C(C21)(Cl)Cl)(Cl)Cl
Spectrum/Structure Validation Score (Raman) 0.960221