![(1R,10R)-bicyclo[8.1.0]undecan-2-one](/api/spectrum/JqbMolmuIDD/structure.png?h=300&w=458 "(1R,10R)-bicyclo[8.1.0]undecan-2-one")
| SpectraBase Compound ID | RpSYXbSBS5 |
|---|---|
| InChI | InChI=1S/C11H18O/c12-11-7-5-3-1-2-4-6-9-8-10(9)11/h9-10H,1-8H2/t9-,10-/m1/s1 |
| InChIKey | XZKQQJUBACJCND-NXEZZACHSA-N |
| Mol Weight | 166.26 g/mol |
| Molecular Formula | C11H18O |
| Exact Mass | 166.135765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JqbMolmuIDD |
|---|---|
| Name | (1R,10R)-Bicyclo[8.1.0]undecan-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.135765199 u |
| Formula | C11H18O |
| InChI | InChI=1S/C11H18O/c12-11-7-5-3-1-2-4-6-9-8-10(9)11/h9-10H,1-8H2/t9-,10-/m1/s1 |
| InChIKey | XZKQQJUBACJCND-NXEZZACHSA-N |
| Molecular Weight | 166.264 g/mol |
| SMILES | [C@@]12(C[C@]2(CCCCCCCC1=O)[H])[H] |