| SpectraBase Compound ID | ADPblSTBECI |
|---|---|
| InChI | InChI=1S/C17H31FO4/c1-3-4-5-6-7-8-10-15(2)22-17(20)12-9-11-16(19)21-14-13-18/h15H,3-14H2,1-2H3 |
| InChIKey | CWDYWLXWXWAIBP-UHFFFAOYSA-N |
| Mol Weight | 318.43 g/mol |
| Molecular Formula | C17H31FO4 |
| Exact Mass | 318.220638 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5gLvRws6D64 |
|---|---|
| Name | Glutaric acid, dec-2-yl 2-fluoroethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.220637637 u |
| Formula | C17H31FO4 |
| InChI | InChI=1S/C17H31FO4/c1-3-4-5-6-7-8-10-15(2)22-17(20)12-9-11-16(19)21-14-13-18/h15H,3-14H2,1-2H3 |
| InChIKey | CWDYWLXWXWAIBP-UHFFFAOYSA-N |
| Molecular Weight | 318.429 g/mol |
| SMILES | C(CCC(OC(CCCCCCCC)C)=O)C(OCCF)=O |