| SpectraBase Compound ID | DDT4UG3jKyR |
|---|---|
| InChI | InChI=1S/C11H15N/c1-3-9(4-2)10-7-5-6-8-11(10)12/h3,5-9H,1,4,12H2,2H3 |
| InChIKey | NRKXGKHGVYYPDG-UHFFFAOYSA-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 | IUPfmJxkSDF |
|---|---|
| Name | Benzenamine, 2-(1-ethyl-2-propenyl)- |
| 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/c1-3-9(4-2)10-7-5-6-8-11(10)12/h3,5-9H,1,4,12H2,2H3 |
| InChIKey | NRKXGKHGVYYPDG-UHFFFAOYSA-N |
| Molecular Weight | 161.248 g/mol |
| SMILES | C=1(C(N)=CC=CC1)C(C=C)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.918267 |