| SpectraBase Compound ID | AoALswivuk3 |
|---|---|
| InChI | InChI=1S/C6H6Cl3F3O2/c1-14-4(13)3(7)2-5(8,9)6(10,11)12/h3H,2H2,1H3 |
| InChIKey | FIMSMXGCUVUWCF-UHFFFAOYSA-N |
| Mol Weight | 273.47 g/mol |
| Molecular Formula | C6H6Cl3F3O2 |
| Exact Mass | 271.938547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dm5QPJqr1Yl |
|---|---|
| Name | 2,4,4-Trichloro-5,5,5-trifluoro-pentanoic acid, methyl ester |
| CAS Registry Number | 68136-87-8 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H6Cl3F3O2 |
| InChI | InChI=1S/C6H6Cl3F3O2/c1-14-4(13)3(7)2-5(8,9)6(10,11)12/h3H,2H2,1H3 |
| InChIKey | FIMSMXGCUVUWCF-UHFFFAOYSA-N |
| Instrument Name | Bruker AM-270 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |