| SpectraBase Compound ID | 7RRn9tes3wF |
|---|---|
| InChI | InChI=1S/C11H15N/c1-2-3-9-12-10-11-7-5-4-6-8-11/h2-8,12H,9-10H2,1H3/b3-2+ |
| InChIKey | USEGQYNVYCNAPA-NSCUHMNNSA-N |
| Mol Weight | 161.25 g/mol |
| Molecular Formula | C11H15N |
| Exact Mass | 161.120449 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IL70RZBxjOZ |
|---|---|
| Name | (2E)-N-Benzyl-2-buten-1-amine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 161.120449487 u |
| Formula | C11H15N |
| InChI | InChI=1S/C11H15N/c1-2-3-9-12-10-11-7-5-4-6-8-11/h2-8,12H,9-10H2,1H3/b3-2+ |
| InChIKey | USEGQYNVYCNAPA-NSCUHMNNSA-N |
| Molecular Weight | 161.248 g/mol |
| SMILES | C(NCC=1C=CC=CC1)\C=C\C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.971366 |