| SpectraBase Compound ID | 9V98Cja11GB |
|---|---|
| InChI | InChI=1S/C6H5F3O3/c1-3-5(11,4(10)12-2)6(7,8)9/h1,11H,2H3 |
| InChIKey | BSJCWEMJCUIAEM-UHFFFAOYSA-N |
| Mol Weight | 182.1 g/mol |
| Molecular Formula | C6H5F3O3 |
| Exact Mass | 182.019079 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BR1YKero0mU |
|---|---|
| Name | 2-HYDROXY-2-TRIFLUORMETHYL-BUT-3-IN-SAEUREMETHYLESTER |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H5F3O3 |
| InChI | InChI=1S/C6H5F3O3/c1-3-5(11,4(10)12-2)6(7,8)9/h1,11H,2H3 |
| InChIKey | BSJCWEMJCUIAEM-UHFFFAOYSA-N |
| Literature Reference Author | N.SEWALD,K.BURGER |
| Literature Reference Citation | Z.NATURFORSCH.,45B,871(1990) |
| Solvent | CDCl3 |
| Source File Reference | UWED8841 |