| SpectraBase Compound ID | 6NSNYwizMR7 |
|---|---|
| InChI | InChI=1S/C13H15NO2/c1-10(15)14-9-5-8-12(13(14)16)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-9H2,1H3 |
| InChIKey | NZLNYRCSBYYNAI-UHFFFAOYSA-N |
| Mol Weight | 217.27 g/mol |
| Molecular Formula | C13H15NO2 |
| Exact Mass | 217.110279 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5mFFq7muSeK |
|---|---|
| Name | 1-Acetyl-3-phenyl-2-piperidone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.110278725 u |
| Formula | C13H15NO2 |
| InChI | InChI=1S/C13H15NO2/c1-10(15)14-9-5-8-12(13(14)16)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-9H2,1H3 |
| InChIKey | NZLNYRCSBYYNAI-UHFFFAOYSA-N |
| Molecular Weight | 217.268 g/mol |
| SMILES | C(=O)(N1C(C(CCC1)C=1C=CC=CC1)=O)C |
| Spectrum/Structure Validation Score (Raman) | 0.961089 |