![2-[5-[(E)-5-(2,2-dimethyl-6-methylene-cyclohexyl)-3-methyl-pent-2-enyl]-1H-imidazol-4-yl]ethanamine](/api/spectrum/EM5intJ2h8c/structure.png?h=300&w=458 "2-[5-[(E)-5-(2,2-dimethyl-6-methylene-cyclohexyl)-3-methyl-pent-2-enyl]-1H-imidazol-4-yl]ethanamine")
| SpectraBase Compound ID | AKSjoGPyBtw |
|---|---|
| InChI | InChI=1S/C20H33N3/c1-15(8-10-18-19(11-13-21)23-14-22-18)7-9-17-16(2)6-5-12-20(17,3)4/h8,14,17H,2,5-7,9-13,21H2,1,3-4H3,(H,22,23)/b15-8+ |
| InChIKey | WFNKMDQDJZMORZ-OVCLIPMQSA-N |
| Mol Weight | 315.5 g/mol |
| Molecular Formula | C20H33N3 |
| Exact Mass | 315.267448 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EM5intJ2h8c |
|---|---|
| Name | 2-[5-[(E)-5-(2,2-Dimethyl-6-methylene-cyclohexyl)-3-methyl-pent-2-enyl]-1H-imidazol-4-yl]ethanamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.267448075 u |
| Formula | C20H33N3 |
| InChI | InChI=1S/C20H33N3/c1-15(8-10-18-19(11-13-21)23-14-22-18)7-9-17-16(2)6-5-12-20(17,3)4/h8,14,17H,2,5-7,9-13,21H2,1,3-4H3,(H,22,23)/b15-8+ |
| InChIKey | WFNKMDQDJZMORZ-OVCLIPMQSA-N |
| Molecular Weight | 315.505 g/mol |
| SMILES | C=1(N=CNC1C\C=C\(CCC1C(=C)CCCC1(C)C)C)CCN |