| SpectraBase Compound ID | 1s02P232bQl |
|---|---|
| InChI | InChI=1S/C18H25F2NO3/c1-2-3-4-5-6-7-8-12-24-16(22)13-21-18(23)17-14(19)10-9-11-15(17)20/h9-11H,2-8,12-13H2,1H3,(H,21,23) |
| InChIKey | UMOFVRKOTRYFPH-UHFFFAOYSA-N |
| Mol Weight | 341.4 g/mol |
| Molecular Formula | C18H25F2NO3 |
| Exact Mass | 341.18025 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lr7EVj2ERAO |
|---|---|
| Name | Glycine, N-(2,6-difluorobenzoyl)-, nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 341.180249992 u |
| Formula | C18H25F2NO3 |
| InChI | InChI=1S/C18H25F2NO3/c1-2-3-4-5-6-7-8-12-24-16(22)13-21-18(23)17-14(19)10-9-11-15(17)20/h9-11H,2-8,12-13H2,1H3,(H,21,23) |
| InChIKey | UMOFVRKOTRYFPH-UHFFFAOYSA-N |
| Molecular Weight | 341.399 g/mol |
| SMILES | C1=CC=C(C(=C1F)C(NCC(OCCCCCCCCC)=O)=O)F |