| SpectraBase Compound ID | GAHsrUHR0ic |
|---|---|
| InChI | InChI=1S/C12H15NO/c1-9-11(14)7-8-13-12(9)10-5-3-2-4-6-10/h2-6,9,12-13H,7-8H2,1H3 |
| InChIKey | WXIFLNDOTSRSQF-UHFFFAOYSA-N |
| Mol Weight | 189.26 g/mol |
| Molecular Formula | C12H15NO |
| Exact Mass | 189.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8QbSmveJljS |
|---|---|
| Name | 3-Methyl-2-phenylpiperidin-4-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.115364106 u |
| Formula | C12H15NO |
| InChI | InChI=1S/C12H15NO/c1-9-11(14)7-8-13-12(9)10-5-3-2-4-6-10/h2-6,9,12-13H,7-8H2,1H3 |
| InChIKey | WXIFLNDOTSRSQF-UHFFFAOYSA-N |
| Molecular Weight | 189.258 g/mol |
| SMILES | C1CC(C(C(N1)C=1C=CC=CC1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.918352 |