| SpectraBase Compound ID | 3dBF6N9djcM |
|---|---|
| InChI | InChI=1S/C12H21N/c1-3-10-13(11-4-2)12-8-6-5-7-9-12/h3-4,12H,1-2,5-11H2 |
| InChIKey | OQPJPTHRWIALLQ-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 | E2WsBf8RGc0 |
|---|---|
| Name | N,N-Diallylcyclohexanamine |
| 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/c1-3-10-13(11-4-2)12-8-6-5-7-9-12/h3-4,12H,1-2,5-11H2 |
| InChIKey | OQPJPTHRWIALLQ-UHFFFAOYSA-N |
| Molecular Weight | 179.307 g/mol |
| SMILES | C(N(CC=C)C1CCCCC1)C=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923265 |