SpectraBase Compound ID | FTz4dpZvitg |
---|---|
InChI | InChI=1S/C8H6Cl4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4,7-8H |
InChIKey | VOWDXSFJQOEFSH-UHFFFAOYSA-N |
Mol Weight | 243.9 g/mol |
Molecular Formula | C8H6Cl4 |
Exact Mass | 241.922361 g/mol |
SpectraBase Spectrum ID | GeWgL4h4hMy |
---|---|
Name | alpha,alpha,alpha',alpha'-Tetrachloro-p-xylene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 241.922360993 u |
Formula | C8H6Cl4 |
InChI | InChI=1S/C8H6Cl4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4,7-8H |
InChIKey | VOWDXSFJQOEFSH-UHFFFAOYSA-N |
Molecular Weight | 243.948 g/mol |
SMILES | C=1C(=CC=C(C1)C(Cl)Cl)C(Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915644 |