| SpectraBase Compound ID | IV1kWFbThOO |
|---|---|
| InChI | InChI=1S/C9H15NO/c1-2-6-9(11)10-7-4-3-5-8-10/h2,6H,3-5,7-8H2,1H3/b6-2+ |
| InChIKey | DEHSTVNSEJEWPR-QHHAFSJGSA-N |
| Mol Weight | 153.22 g/mol |
| Molecular Formula | C9H15NO |
| Exact Mass | 153.115364 g/mol |
| SpectraBase Spectrum ID | 2BDa5wus8iI |
|---|---|
| Name | Piperidine, 1-(1-oxo-2-butenyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 153.115364106 u |
| Formula | C9H15NO |
| InChI | InChI=1S/C9H15NO/c1-2-6-9(11)10-7-4-3-5-8-10/h2,6H,3-5,7-8H2,1H3/b6-2+ |
| InChIKey | DEHSTVNSEJEWPR-QHHAFSJGSA-N |
| Molecular Weight | 153.225 g/mol |
| SMILES | C(\C=C\C)(=O)N1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.987945 |