![5-[7-(1H-imidazol-5-yl)heptyl]-1H-imidazole](/api/spectrum/IGhgLfSE0Lx/structure.png?h=300&w=458 "5-[7-(1H-imidazol-5-yl)heptyl]-1H-imidazole")
| SpectraBase Compound ID | 2eeBk6spxVI |
|---|---|
| InChI | InChI=1S/C13H20N4/c1(2-4-6-12-8-14-10-16-12)3-5-7-13-9-15-11-17-13/h8-11H,1-7H2,(H,14,16)(H,15,17) |
| InChIKey | UKKGURUSIGSHBC-UHFFFAOYSA-N |
| Mol Weight | 232.33 g/mol |
| Molecular Formula | C13H20N4 |
| Exact Mass | 232.168797 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IGhgLfSE0Lx |
|---|---|
| Name | 5-[7-(1H-Imidazol-5-yl)heptyl]-1H-imidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.168796660 u |
| Formula | C13H20N4 |
| InChI | InChI=1S/C13H20N4/c1(2-4-6-12-8-14-10-16-12)3-5-7-13-9-15-11-17-13/h8-11H,1-7H2,(H,14,16)(H,15,17) |
| InChIKey | UKKGURUSIGSHBC-UHFFFAOYSA-N |
| Molecular Weight | 232.331 g/mol |
| SMILES | C1=NC(=CN1)CCCCCCCC=1N=CNC1 |