| SpectraBase Compound ID | 1QjDwkIBzKu |
|---|---|
| InChI | InChI=1S/C7H11NO.ClH/c9-7-5-8-3-1-6(7)2-4-8;/h6H,1-5H2;1H |
| InChIKey | RFDPHKHXPMDJJD-UHFFFAOYSA-N |
| Mol Weight | 160.62 g/mol |
| Molecular Formula | C7H11ClNO |
| Exact Mass | 160.052917 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Fm9OoQ9iF7F |
|---|---|
| Name | 3-Quinuclidinone, hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 161.060741709 u |
| Formula | C7H12ClNO |
| InChI | InChI=1S/C7H11NO.ClH/c9-7-5-8-3-1-6(7)2-4-8;/h6H,1-5H2;1H |
| InChIKey | RFDPHKHXPMDJJD-UHFFFAOYSA-N |
| Molecular Weight | 161.632 g/mol |
| SMILES | Cl.C1CC2C(CN1CC2)=O |
| Spectrum/Structure Validation Score (Raman) | 0.950989 |