| SpectraBase Compound ID | AnoSSJGeKRS |
|---|---|
| InChI | InChI=1S/C11H15N/c1-2-11(12)9-8-10-6-4-3-5-7-10/h3-9,11H,2,12H2,1H3/b9-8+ |
| InChIKey | CBFMVFJLOTUWLK-CMDGGOBGSA-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 | 9RCbahpMmhq |
|---|---|
| Name | (E)-1-Phenyl-1-penten-3-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/c1-2-11(12)9-8-10-6-4-3-5-7-10/h3-9,11H,2,12H2,1H3/b9-8+ |
| InChIKey | CBFMVFJLOTUWLK-CMDGGOBGSA-N |
| Molecular Weight | 161.248 g/mol |
| SMILES | C1(\C=C\C(CC)N)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942669 |