![Endo-bicyclo[3.3.1]nonan-3-carboxylic acid](/api/spectrum/IxoGOimIR6P/structure.png?h=300&w=458 "Endo-bicyclo[3.3.1]nonan-3-carboxylic acid")
| SpectraBase Compound ID | JOomkQuIPlO |
|---|---|
| InChI | InChI=1S/C10H16O2/c11-10(12)9-5-7-2-1-3-8(4-7)6-9/h7-9H,1-6H2,(H,11,12)/t7-,8+,9? |
| InChIKey | XJKUZAYHWMSZNC-JVHMLUBASA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IxoGOimIR6P |
|---|---|
| Name | Endo-bicyclo[3.3.1]nonan-3-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c11-10(12)9-5-7-2-1-3-8(4-7)6-9/h7-9H,1-6H2,(H,11,12)/t7-,8+,9? |
| InChIKey | XJKUZAYHWMSZNC-JVHMLUBASA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C1[C@]2(CCC[C@](C2)(CC1C(O)=O)[H])[H] |