| SpectraBase Compound ID | 3IWdFTjEEFn |
|---|---|
| InChI | InChI=1S/C13H14N2/c1-2-6-12(7-3-1)10-14-11-13-8-4-5-9-15-13/h1-9,14H,10-11H2 |
| InChIKey | RRLRWANEZGPBAD-UHFFFAOYSA-N |
| Mol Weight | 198.27 g/mol |
| Molecular Formula | C13H14N2 |
| Exact Mass | 198.115698 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7ZVtaoCdhVe |
|---|---|
| Name | 1-Phenyl-N-(2-pyridinylmethyl)methanamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.115698459 u |
| Formula | C13H14N2 |
| InChI | InChI=1S/C13H14N2/c1-2-6-12(7-3-1)10-14-11-13-8-4-5-9-15-13/h1-9,14H,10-11H2 |
| InChIKey | RRLRWANEZGPBAD-UHFFFAOYSA-N |
| Molecular Weight | 198.269 g/mol |
| SMILES | C=1(C=CC=CN1)CNCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.983095 |