| SpectraBase Compound ID | 4rrTW74ku4P |
|---|---|
| InChI | InChI=1S/C11H26N2/c1-2-3-4-5-6-8-11(13)9-7-10-12/h11H,2-10,12-13H2,1H3 |
| InChIKey | BVONAPRHFRSVEP-UHFFFAOYSA-N |
| Mol Weight | 186.34 g/mol |
| Molecular Formula | C11H26N2 |
| Exact Mass | 186.209599 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LAZJ4vxN5wG |
|---|---|
| Name | 1-(3-Aminopropyl)octylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.209598845 u |
| Formula | C11H26N2 |
| InChI | InChI=1S/C11H26N2/c1-2-3-4-5-6-8-11(13)9-7-10-12/h11H,2-10,12-13H2,1H3 |
| InChIKey | BVONAPRHFRSVEP-UHFFFAOYSA-N |
| Molecular Weight | 186.343 g/mol |
| SMILES | C(N)(CCCN)CCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930083 |