| SpectraBase Compound ID | KdXPPMf8XV2 |
|---|---|
| InChI | InChI=1S/C17H20FNO2/c1-11(12-3-5-13(18)6-4-12)17(20)21-16-9-14-7-8-15(10-16)19(14)2/h3-6,14-16H,1,7-10H2,2H3 |
| InChIKey | HLHPFEFVVSCXBC-UHFFFAOYSA-N |
| Mol Weight | 289.35 g/mol |
| Molecular Formula | C17H20FNO2 |
| Exact Mass | 289.147807 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Efwigfwcdrx |
|---|---|
| Name | p-Fluoroatropine dehydrate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.147807049 u |
| Formula | C17H20FNO2 |
| InChI | InChI=1S/C17H20FNO2/c1-11(12-3-5-13(18)6-4-12)17(20)21-16-9-14-7-8-15(10-16)19(14)2/h3-6,14-16H,1,7-10H2,2H3 |
| InChIKey | HLHPFEFVVSCXBC-UHFFFAOYSA-N |
| Molecular Weight | 289.350 g/mol |
| SMILES | C1=C(C=CC(=C1)C(=C)C(OC1CC2N(C(C1)CC2)C)=O)F |