| SpectraBase Compound ID | KrNHg3fK98X |
|---|---|
| InChI | InChI=1S/C12H23N/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h10-12H,1-9,13H2 |
| InChIKey | KEHCTKVZDAEDPP-UHFFFAOYSA-N |
| Mol Weight | 181.32 g/mol |
| Molecular Formula | C12H23N |
| Exact Mass | 181.18305 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GjWpxUbaRYJ |
|---|---|
| Name | (Bicyclohexyl)-2-amine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.183049745 u |
| Formula | C12H23N |
| InChI | InChI=1S/C12H23N/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h10-12H,1-9,13H2 |
| InChIKey | KEHCTKVZDAEDPP-UHFFFAOYSA-N |
| Molecular Weight | 181.323 g/mol |
| SMILES | C1(N)C(CCCC1)C1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967713 |