| SpectraBase Compound ID | ATVJOt1abDs |
|---|---|
| InChI | InChI=1S/C10H15F3O4/c1-2-6-16-8(14)4-3-5-9(15)17-7-10(11,12)13/h2-7H2,1H3 |
| InChIKey | YCHZWCBSMYBBAV-UHFFFAOYSA-N |
| Mol Weight | 256.22 g/mol |
| Molecular Formula | C10H15F3O4 |
| Exact Mass | 256.092243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | oFp9fnC7eD |
|---|---|
| Name | Glutaric acid, 2,2,2-triluoroethyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.092243448 u |
| Formula | C10H15F3O4 |
| InChI | InChI=1S/C10H15F3O4/c1-2-6-16-8(14)4-3-5-9(15)17-7-10(11,12)13/h2-7H2,1H3 |
| InChIKey | YCHZWCBSMYBBAV-UHFFFAOYSA-N |
| Molecular Weight | 256.221 g/mol |
| SMILES | C(CCCC(OCC(F)(F)F)=O)(OCCC)=O |