| SpectraBase Compound ID | FAvuGPRxNTB |
|---|---|
| InChI | InChI=1S/C11H11F7O2/c12-9(13,10(14,15)11(16,17)18)8(19)20-7(5-1-2-5)6-3-4-6/h5-7H,1-4H2 |
| InChIKey | JUXVOLYQBUJKLH-UHFFFAOYSA-N |
| Mol Weight | 308.2 g/mol |
| Molecular Formula | C11H11F7O2 |
| Exact Mass | 308.064727 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1hf4csbWkNe |
|---|---|
| Name | Dicyclopropylmethanol, heptafluorobutyrate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 308.064726733 u |
| Formula | C11H11F7O2 |
| InChI | InChI=1S/C11H11F7O2/c12-9(13,10(14,15)11(16,17)18)8(19)20-7(5-1-2-5)6-3-4-6/h5-7H,1-4H2 |
| InChIKey | JUXVOLYQBUJKLH-UHFFFAOYSA-N |
| Molecular Weight | 308.196 g/mol |
| SMILES | C1(C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C2CC2)CC1 |