| SpectraBase Compound ID | LVMu1TJwwI6 |
|---|---|
| InChI | InChI=1S/C13H11F5O2/c14-12(15,13(16,17)18)11(19)20-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2 |
| InChIKey | UFUJVCQEAMSLEE-UHFFFAOYSA-N |
| Mol Weight | 294.22 g/mol |
| Molecular Formula | C13H11F5O2 |
| Exact Mass | 294.06792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BXV7JdkIVEi |
|---|---|
| Name | 1,2,3,4-Tetrahydronaphthalen-1-yl 2,2,3,3,3-pentafluoropropanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.067920407 u |
| Formula | C13H11F5O2 |
| InChI | InChI=1S/C13H11F5O2/c14-12(15,13(16,17)18)11(19)20-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2 |
| InChIKey | UFUJVCQEAMSLEE-UHFFFAOYSA-N |
| Molecular Weight | 294.221 g/mol |
| SMILES | C1CC(OC(=O)C(F)(C(F)(F)F)F)C=2C(C1)=CC=CC2 |