![1,6-bis[2',5'-Dimethyl-1H-pyrrol-1'-yl]-hexane](/api/spectrum/6TOMaGKu7R4/structure.png?h=300&w=458 "1,6-bis[2',5'-Dimethyl-1H-pyrrol-1'-yl]-hexane")
| SpectraBase Compound ID | JDBzcDR55gY |
|---|---|
| InChI | InChI=1S/C18H28N2/c1-15-9-10-16(2)19(15)13-7-5-6-8-14-20-17(3)11-12-18(20)4/h9-12H,5-8,13-14H2,1-4H3 |
| InChIKey | OXQNQMMTHSLQPT-UHFFFAOYSA-N |
| Mol Weight | 272.44 g/mol |
| Molecular Formula | C18H28N2 |
| Exact Mass | 272.225249 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6TOMaGKu7R4 |
|---|---|
| Name | 1,6-bis[2',5'-Dimethyl-1H-pyrrol-1'-yl]-hexane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.225248910 u |
| Formula | C18H28N2 |
| InChI | InChI=1S/C18H28N2/c1-15-9-10-16(2)19(15)13-7-5-6-8-14-20-17(3)11-12-18(20)4/h9-12H,5-8,13-14H2,1-4H3 |
| InChIKey | OXQNQMMTHSLQPT-UHFFFAOYSA-N |
| SMILES | C(N1C(=CC=C1C)C)CCCCCN1C(=CC=C1C)C |