| SpectraBase Compound ID | GdOVvg9jHGb |
|---|---|
| InChI | InChI=1S/C13H12FNO3/c1-2-5-15-7-10(13(17)18)12(16)9-6-8(14)3-4-11(9)15/h3-4,6-7H,2,5H2,1H3,(H,17,18) |
| InChIKey | AXESECUUDQNNCY-UHFFFAOYSA-N |
| Mol Weight | 249.24 g/mol |
| Molecular Formula | C13H12FNO3 |
| Exact Mass | 249.080121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5p7WlLwOjWm |
|---|---|
| Name | 6-Fluoro-4-oxo-1-propyl-1,4-dihydro-3-quinolinecarboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.080121410 u |
| Formula | C13H12FNO3 |
| InChI | InChI=1S/C13H12FNO3/c1-2-5-15-7-10(13(17)18)12(16)9-6-8(14)3-4-11(9)15/h3-4,6-7H,2,5H2,1H3,(H,17,18) |
| InChIKey | AXESECUUDQNNCY-UHFFFAOYSA-N |
| Molecular Weight | 249.241 g/mol |
| SMILES | C1(F)=CC2=C(C=C1)N(C=C(C2=O)C(=O)O)CCC |