| SpectraBase Compound ID | 17j3Uh678cx |
|---|---|
| InChI | InChI=1S/C13H17F5O2/c1-7(2)9-5-4-8(3)10(6-9)20-11(19)12(14,15)13(16,17)18/h8-10H,1,4-6H2,2-3H3 |
| InChIKey | XENKPVFDYIZYSG-UHFFFAOYSA-N |
| Mol Weight | 300.27 g/mol |
| Molecular Formula | C13H17F5O2 |
| Exact Mass | 300.114871 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BtR8M28pZ7x |
|---|---|
| Name | (+)-dihydrocarveol, pentafluoropropionate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.114870600 u |
| Formula | C13H17F5O2 |
| InChI | InChI=1S/C13H17F5O2/c1-7(2)9-5-4-8(3)10(6-9)20-11(19)12(14,15)13(16,17)18/h8-10H,1,4-6H2,2-3H3 |
| InChIKey | XENKPVFDYIZYSG-UHFFFAOYSA-N |
| Molecular Weight | 300.269 g/mol |
| SMILES | C(C)(=C)C1CC(OC(C(C(F)(F)F)(F)F)=O)C(CC1)C |