| SpectraBase Compound ID | 9NeoSs0KUxl |
|---|---|
| InChI | InChI=1S/C12H17N/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1,3-4,7-8H,2,5-6,9-11H2 |
| InChIKey | NZVZVGPYTICZBZ-UHFFFAOYSA-N |
| Mol Weight | 175.27 g/mol |
| Molecular Formula | C12H17N |
| Exact Mass | 175.1361 g/mol |
| SpectraBase Spectrum ID | LWnj7JV8LbP |
|---|---|
| Name | 1-Benzylpiperidin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.136099551 u |
| Formula | C12H17N |
| InChI | InChI=1S/C12H17N/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1,3-4,7-8H,2,5-6,9-11H2 |
| InChIKey | NZVZVGPYTICZBZ-UHFFFAOYSA-N |
| Molecular Weight | 175.275 g/mol |
| SMILES | C1N(CCCC1)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.94917 |