| SpectraBase Compound ID | 7WP6VkL2Arn |
|---|---|
| InChI | InChI=1S/C18H20F3NO4/c1-22-12-7-8-13(22)10-14(9-12)25-16(23)15(11-5-3-2-4-6-11)26-17(24)18(19,20)21/h2-6,12-15H,7-10H2,1H3 |
| InChIKey | JXFBQIOJQQDJBD-UHFFFAOYSA-N |
| Mol Weight | 371.36 g/mol |
| Molecular Formula | C18H20F3NO4 |
| Exact Mass | 371.134443 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CSQvIzXKj07 |
|---|---|
| Name | dl-Homatropine trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 371.134442613 u |
| Formula | C18H20F3NO4 |
| InChI | InChI=1S/C18H20F3NO4/c1-22-12-7-8-13(22)10-14(9-12)25-16(23)15(11-5-3-2-4-6-11)26-17(24)18(19,20)21/h2-6,12-15H,7-10H2,1H3 |
| InChIKey | JXFBQIOJQQDJBD-UHFFFAOYSA-N |
| Molecular Weight | 371.356 g/mol |
| SMILES | C1CC2CC(CC1N2C)OC(C(OC(C(F)(F)F)=O)C1=CC=CC=C1)=O |