| SpectraBase Compound ID | 8yBWNvO5il1 |
|---|---|
| InChI | InChI=1S/C14H17ClN2O3/c1-11(18)16-6-8-17(9-7-16)14(19)10-20-13-4-2-12(15)3-5-13/h2-5H,6-10H2,1H3 |
| InChIKey | GDMDWWIPJXSYMA-UHFFFAOYSA-N |
| Mol Weight | 296.75 g/mol |
| Molecular Formula | C14H17ClN2O3 |
| Exact Mass | 296.09277 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AmcZnVvqGqx |
|---|---|
| Name | Fipexide-m (N-dealkyl-) ac P884 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.092770112 u |
| Formula | C14H17ClN2O3 |
| InChI | InChI=1S/C14H17ClN2O3/c1-11(18)16-6-8-17(9-7-16)14(19)10-20-13-4-2-12(15)3-5-13/h2-5H,6-10H2,1H3 |
| InChIKey | GDMDWWIPJXSYMA-UHFFFAOYSA-N |
| SMILES | CC(N1CCN(CC1)C(COC1=CC=C(C=C1)Cl)=O)=O |