| SpectraBase Compound ID | Dngd7o9M9Cv |
|---|---|
| InChI | InChI=1S/C9H15NO2/c1-8(11)7-9(12)10-5-3-2-4-6-10/h2-7H2,1H3 |
| InChIKey | OVIHQCKYIOKFFX-UHFFFAOYSA-N |
| Mol Weight | 169.22 g/mol |
| Molecular Formula | C9H15NO2 |
| Exact Mass | 169.110279 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7jBBkwSQeVt |
|---|---|
| Name | 1-(Piperidin-1-yl)-butane-1,3-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.110278725 u |
| Formula | C9H15NO2 |
| InChI | InChI=1S/C9H15NO2/c1-8(11)7-9(12)10-5-3-2-4-6-10/h2-7H2,1H3 |
| InChIKey | OVIHQCKYIOKFFX-UHFFFAOYSA-N |
| Molecular Weight | 169.224 g/mol |
| SMILES | C(=O)(CC(=O)C)N1CCCCC1 |
| Spectrum/Structure Validation Score (Raman) | 0.79397 |