| SpectraBase Compound ID | 8SwSQnKXzbT |
|---|---|
| InChI | InChI=1S/C11HF21O2/c12-2(13,1(33)34)3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)11(30,31)32/h(H,33,34) |
| InChIKey | SIDINRCMMRKXGQ-UHFFFAOYSA-N |
| Mol Weight | 564.09 g/mol |
| Molecular Formula | C11HF21O2 |
| Exact Mass | 563.964121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DpaxArj6uJS |
|---|---|
| Name | Perfluoroundecanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 563.964120693 u |
| Formula | C11HF21O2 |
| InChI | InChI=1S/C11HF21O2/c12-2(13,1(33)34)3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)11(30,31)32/h(H,33,34) |
| InChIKey | SIDINRCMMRKXGQ-UHFFFAOYSA-N |
| Molecular Weight | 564.093 g/mol |
| SMILES | C(F)(C(=O)O)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F |