| SpectraBase Compound ID | 3gQbdgYFMD6 |
|---|---|
| InChI | InChI=1S/C19H23NO5/c1-12(21)20-15-8-9-16(20)11-17(10-15)25-19(23)18(24-13(2)22)14-6-4-3-5-7-14/h3-7,15-18H,8-11H2,1-2H3 |
| InChIKey | LXQINIYVHFFKHX-UHFFFAOYSA-N |
| Mol Weight | 345.4 g/mol |
| Molecular Formula | C19H23NO5 |
| Exact Mass | 345.157623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 59c9HO23jIW |
|---|---|
| Name | Homatropine-m (nor-) 2ac P1185 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 345.157622840 u |
| Formula | C19H23NO5 |
| InChI | InChI=1S/C19H23NO5/c1-12(21)20-15-8-9-16(20)11-17(10-15)25-19(23)18(24-13(2)22)14-6-4-3-5-7-14/h3-7,15-18H,8-11H2,1-2H3 |
| InChIKey | LXQINIYVHFFKHX-UHFFFAOYSA-N |
| Molecular Weight | 345.395 g/mol |
| SMILES | C12CCC(CC(C2)OC(=O)C(OC(C)=O)C2=CC=CC=C2)N1C(C)=O |