![N-Hexyl-N-{[3'-(hexylamino]propyl}propane-1,3-diamine](/api/spectrum/4hx1XfHAMVu/structure.png?h=300&w=458 "N-Hexyl-N-{[3'-(hexylamino]propyl}propane-1,3-diamine")
| SpectraBase Compound ID | 3iadPlMwJEd |
|---|---|
| InChI | InChI=1S/C18H41N3/c1-3-5-7-9-14-20-15-12-18-21(17-11-13-19)16-10-8-6-4-2/h20H,3-19H2,1-2H3 |
| InChIKey | MIWILLLCXGRXPX-UHFFFAOYSA-N |
| Mol Weight | 299.5 g/mol |
| Molecular Formula | C18H41N3 |
| Exact Mass | 299.330048 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4hx1XfHAMVu |
|---|---|
| Name | N-Hexyl-N-{[3'-(hexylamino]propyl}propane-1,3-diamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.330048332 u |
| Formula | C18H41N3 |
| InChI | InChI=1S/C18H41N3/c1-3-5-7-9-14-20-15-12-18-21(17-11-13-19)16-10-8-6-4-2/h20H,3-19H2,1-2H3 |
| InChIKey | MIWILLLCXGRXPX-UHFFFAOYSA-N |
| SMILES | C(N(CCCNCCCCCC)CCCCCC)CCN |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.970248 |