| SpectraBase Compound ID | ELb7EljdU5t |
|---|---|
| InChI | InChI=1S/C6H4ClF3O2/c7-5(6(8,9)10)3(11)1-2-4(5)12/h1-2H2 |
| InChIKey | ITWCMCJTIUZSFS-UHFFFAOYSA-N |
| Mol Weight | 200.54 g/mol |
| Molecular Formula | C6H4ClF3O2 |
| Exact Mass | 199.985192 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ul4T5LTQPz |
|---|---|
| Name | 2-Chloro-2-trifluoromethyl-1,3-cyclopentanedione |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H4ClF3O2 |
| InChI | InChI=1S/C6H4ClF3O2/c7-5(6(8,9)10)3(11)1-2-4(5)12/h1-2H2 |
| InChIKey | ITWCMCJTIUZSFS-UHFFFAOYSA-N |
| Molecular Weight | 200.544 g/mol |
| SMILES | C1(C(C(CC1)=O)(C(F)(F)F)Cl)=O |
| SPLASH | splash10-0pb9-9080000000-3cbfec81fe3c6d01f778 |
| Source of Spectrum | SO-0-1120-3 |
| Wiley ID | 1538738 |