| SpectraBase Compound ID | LGIClo4cErB |
|---|---|
| InChI | InChI=1S/C11H19N/c12-10-6-2-5-9-11-7-3-1-4-8-11/h11H,1-9H2 |
| InChIKey | GBVKMZARVUQOAF-UHFFFAOYSA-N |
| Mol Weight | 165.28 g/mol |
| Molecular Formula | C11H19N |
| Exact Mass | 165.15175 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AoLjisWYenS |
|---|---|
| Name | 5-Cyclohexylpentanenitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 165.151749616 u |
| Formula | C11H19N |
| InChI | InChI=1S/C11H19N/c12-10-6-2-5-9-11-7-3-1-4-8-11/h11H,1-9H2 |
| InChIKey | GBVKMZARVUQOAF-UHFFFAOYSA-N |
| Molecular Weight | 165.280 g/mol |
| SMILES | C(CCCCC1CCCCC1)#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.929888 |