| SpectraBase Compound ID | I8Fa0iXQ5hC |
|---|---|
| InChI | InChI=1S/C10H15F5O2/c1-2-3-4-5-6-7-17-8(16)9(11,12)10(13,14)15/h2-7H2,1H3 |
| InChIKey | XVYGQEAPOGQAKL-UHFFFAOYSA-N |
| Mol Weight | 262.22 g/mol |
| Molecular Formula | C10H15F5O2 |
| Exact Mass | 262.099221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E5NrQBiEusE |
|---|---|
| Name | Pentafluoropropionic acid, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.099220536 u |
| Formula | C10H15F5O2 |
| InChI | InChI=1S/C10H15F5O2/c1-2-3-4-5-6-7-17-8(16)9(11,12)10(13,14)15/h2-7H2,1H3 |
| InChIKey | XVYGQEAPOGQAKL-UHFFFAOYSA-N |
| Molecular Weight | 262.220 g/mol |
| SMILES | C(C(=O)OCCCCCCC)(C(F)(F)F)(F)F |