| SpectraBase Spectrum ID |
5ZfsGoN8Xtw |
| Name |
2-Chloro-1-(2,4-dichlorophenyl)ethanone |
| CAS Registry Number |
4252-78-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
221.940597880 u |
| Formula |
C8H5Cl3O |
| InChI |
InChI=1S/C8H5Cl3O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H2 |
| InChIKey |
VYWPPRLJNVHPEU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
223.486 g/mol |
| Nominal Mass |
222 u |
| Quality |
983 |
| Retention Index |
1453 |
| SMILES |
C1(=C(C(CCl)=O)C=CC(=C1)Cl)Cl |
| SPLASH |
splash10-00fr-2900000000-5b6c9f1b9a08887dc7dc |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000542 |
