| SpectraBase Compound ID | 5n5JfIwndPK |
|---|---|
| InChI | InChI=1S/C19H27F2NO3/c1-2-3-4-5-6-7-8-9-13-25-17(23)14-22-19(24)18-15(20)11-10-12-16(18)21/h10-12H,2-9,13-14H2,1H3,(H,22,24) |
| InChIKey | KGEBDLITAUHCDM-UHFFFAOYSA-N |
| Mol Weight | 355.43 g/mol |
| Molecular Formula | C19H27F2NO3 |
| Exact Mass | 355.1959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9qjRZD3rabI |
|---|---|
| Name | Glycine, N-(2,6-difluorobenzoyl)-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 355.195900056 u |
| Formula | C19H27F2NO3 |
| InChI | InChI=1S/C19H27F2NO3/c1-2-3-4-5-6-7-8-9-13-25-17(23)14-22-19(24)18-15(20)11-10-12-16(18)21/h10-12H,2-9,13-14H2,1H3,(H,22,24) |
| InChIKey | KGEBDLITAUHCDM-UHFFFAOYSA-N |
| Molecular Weight | 355.426 g/mol |
| SMILES | C1=CC=C(C(=C1F)C(NCC(OCCCCCCCCCC)=O)=O)F |