| SpectraBase Compound ID | 9wrP8hRl9FH |
|---|---|
| InChI | InChI=1S/C17H24FNO3/c1-2-3-4-5-6-9-12-22-16(20)13-19-17(21)14-10-7-8-11-15(14)18/h7-8,10-11H,2-6,9,12-13H2,1H3,(H,19,21) |
| InChIKey | XKGOMUDDYAUXTL-UHFFFAOYSA-N |
| Mol Weight | 309.38 g/mol |
| Molecular Formula | C17H24FNO3 |
| Exact Mass | 309.174022 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DLiclGIaEDY |
|---|---|
| Name | Glycine, N-(2-fluorobenzoyl)-, octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.174021797 u |
| Formula | C17H24FNO3 |
| InChI | InChI=1S/C17H24FNO3/c1-2-3-4-5-6-9-12-22-16(20)13-19-17(21)14-10-7-8-11-15(14)18/h7-8,10-11H,2-6,9,12-13H2,1H3,(H,19,21) |
| InChIKey | XKGOMUDDYAUXTL-UHFFFAOYSA-N |
| Molecular Weight | 309.381 g/mol |
| SMILES | C1(=CC=CC=C1C(NCC(OCCCCCCCC)=O)=O)F |