| SpectraBase Compound ID | 7iid01Fr2rD |
|---|---|
| InChI | InChI=1S/C4H5Cl3O/c1-2(5)3(8)4(6)7/h2,4H,1H3 |
| InChIKey | QTGXVEKFZMQAHV-UHFFFAOYSA-N |
| Mol Weight | 175.44 g/mol |
| Molecular Formula | C4H5Cl3O |
| Exact Mass | 173.940598 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DU8DuRw3Mqm |
|---|---|
| Name | 1,1,3-Trichlorobutan-2-one |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C4H5Cl3O |
| InChI | InChI=1S/C4H5Cl3O/c1-2(5)3(8)4(6)7/h2,4H,1H3 |
| InChIKey | QTGXVEKFZMQAHV-UHFFFAOYSA-N |
| Molecular Weight | 175.442 g/mol |
| SMILES | C(C(C(C)Cl)=O)(Cl)Cl |
| SPLASH | splash10-03di-4900000000-5bea423be02a42235cf0 |
| Source of Spectrum | SO-0-1004-4 |
| Synonyms | 1,1,3-trichloro-2-butanone 1,1,3-tris(chloranyl)butan-2-one |
| Wiley ID | 1541783 |