| SpectraBase Compound ID | 7f9ooAo9C0k |
|---|---|
| InChI | InChI=1S/C4H6Cl4/c5-2-1-4(7,8)3-6/h1-3H2 |
| InChIKey | KVDHZPQOODBZDP-UHFFFAOYSA-N |
| Mol Weight | 195.9 g/mol |
| Molecular Formula | C4H6Cl4 |
| Exact Mass | 193.922361 g/mol |
| SpectraBase Spectrum ID | 2P9Sy693sNF |
|---|---|
| Name | Butane, 1,2,2,4-tetrachloro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.922360993 u |
| Formula | C4H6Cl4 |
| InChI | InChI=1S/C4H6Cl4/c5-2-1-4(7,8)3-6/h1-3H2 |
| InChIKey | KVDHZPQOODBZDP-UHFFFAOYSA-N |
| SMILES | C(Cl)CC(CCl)(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916212 |