| SpectraBase Compound ID | AGc0Zn2Ow23 |
|---|---|
| InChI | InChI=1S/C13H13N/c1-2-5-12(6-3-1)8-9-13-7-4-10-14-11-13/h1-7,10-11H,8-9H2 |
| InChIKey | DXKCYWXEHAMAQW-UHFFFAOYSA-N |
| Mol Weight | 183.25 g/mol |
| Molecular Formula | C13H13N |
| Exact Mass | 183.104799 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JLIzrguKNpR |
|---|---|
| Name | 3-(2-Phenylethyl)pyridine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.104799423 u |
| Formula | C13H13N |
| InChI | InChI=1S/C13H13N/c1-2-5-12(6-3-1)8-9-13-7-4-10-14-11-13/h1-7,10-11H,8-9H2 |
| InChIKey | DXKCYWXEHAMAQW-UHFFFAOYSA-N |
| Molecular Weight | 183.254 g/mol |
| Nominal Mass | 183 u |
| SMILES | C1(CCC2=CC=CN=C2)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.986381 |