| SpectraBase Compound ID | 4tWfGDxiYII |
|---|---|
| InChI | InChI=1S/C12H19NO2/c1-3-8(2)12(14)15-11-6-9-4-5-10(7-11)13-9/h3,9-11,13H,4-7H2,1-2H3/b8-3+/t9-,10+,11+ |
| InChIKey | KLFGVBUPYUSQKV-YBOYPCLQSA-N |
| Mol Weight | 209.29 g/mol |
| Molecular Formula | C12H19NO2 |
| Exact Mass | 209.141579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JXzTUGO8qWx |
|---|---|
| Name | 3.alpha.-Tigloyloxynortropane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.141578854 u |
| Formula | C12H19NO2 |
| InChI | InChI=1S/C12H19NO2/c1-3-8(2)12(14)15-11-6-9-4-5-10(7-11)13-9/h3,9-11,13H,4-7H2,1-2H3/b8-3+/t9-,10+,11+ |
| InChIKey | KLFGVBUPYUSQKV-YBOYPCLQSA-N |
| Molecular Weight | 209.289 g/mol |
| SMILES | C1C[C@@]2(C[C@](C[C@]1(N2)[H])(OC(\C(=C\C)C)=O)[H])[H] |