| SpectraBase Compound ID | 9lqUGCw1acd |
|---|---|
| InChI | InChI=1S/C17H22FNO3/c1-19-13-5-6-14(19)9-15(8-13)22-17(21)16(10-20)11-3-2-4-12(18)7-11/h2-4,7,13-16,20H,5-6,8-10H2,1H3 |
| InChIKey | YNAYPMBQGYLLKB-UHFFFAOYSA-N |
| Mol Weight | 307.37 g/mol |
| Molecular Formula | C17H22FNO3 |
| Exact Mass | 307.158372 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BJvqf8MQnX2 |
|---|---|
| Name | Fluoroatropine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.158371732 u |
| Formula | C17H22FNO3 |
| InChI | InChI=1S/C17H22FNO3/c1-19-13-5-6-14(19)9-15(8-13)22-17(21)16(10-20)11-3-2-4-12(18)7-11/h2-4,7,13-16,20H,5-6,8-10H2,1H3 |
| InChIKey | YNAYPMBQGYLLKB-UHFFFAOYSA-N |
| Molecular Weight | 307.365 g/mol |
| SMILES | C12CC(CC(N2C)CC1)OC(=O)C(C1=CC=CC(=C1)F)CO |