| SpectraBase Compound ID | 4nVNsANQrna |
|---|---|
| InChI | InChI=1S/C22H38FNO/c23-19-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-18-22(25)24-20-16-17-21-24/h1-2,5,7H,3-4,6,8-21H2/b2-1-,7-5- |
| InChIKey | DHMWQGMMIBSJDJ-PQZOIKATSA-N |
| Mol Weight | 351.6 g/mol |
| Molecular Formula | C22H38FNO |
| Exact Mass | 351.293743 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JyZ86qNs8kc |
|---|---|
| Name | 18-Fluoro-octadec-9,12-dienoic acid, pyrrolidide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 351.293743010 u |
| Formula | C22H38FNO |
| InChI | InChI=1S/C22H38FNO/c23-19-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-18-22(25)24-20-16-17-21-24/h1-2,5,7H,3-4,6,8-21H2/b2-1-,7-5- |
| InChIKey | DHMWQGMMIBSJDJ-PQZOIKATSA-N |
| Molecular Weight | 351.550 g/mol |
| SMILES | C1N(CCC1)C(CCCCCCC\C=C/C\C=C/CCCCCF)=O |