| SpectraBase Compound ID | 3ujlyldikYt |
|---|---|
| InChI | InChI=1S/C12H21N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2H,1,3-11H2 |
| InChIKey | JCXSQWLYMCCGSN-UHFFFAOYSA-N |
| Mol Weight | 179.31 g/mol |
| Molecular Formula | C12H21N |
| Exact Mass | 179.1674 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IuW8bCvBWVt |
|---|---|
| Name | 11-Dodecenenitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 179.167399680 u |
| Formula | C12H21N |
| InChI | InChI=1S/C12H21N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2H,1,3-11H2 |
| InChIKey | JCXSQWLYMCCGSN-UHFFFAOYSA-N |
| Molecular Weight | 179.307 g/mol |
| SMILES | C(CCCCCCCCCC=C)#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909501 |