![2-[(E)-1-(4-methylphenyl)prop-1-en-2-yl]-1H-benzimidazole](/api/spectrum/449fe3FsIOw/structure.png?h=300&w=458 "2-[(E)-1-(4-methylphenyl)prop-1-en-2-yl]-1H-benzimidazole")
| SpectraBase Compound ID | L8QozE0DwtA |
|---|---|
| InChI | InChI=1S/C17H16N2/c1-12-7-9-14(10-8-12)11-13(2)17-18-15-5-3-4-6-16(15)19-17/h3-11H,1-2H3,(H,18,19)/b13-11+ |
| InChIKey | NJPYDNHPRXDALE-ACCUITESSA-N |
| Mol Weight | 248.33 g/mol |
| Molecular Formula | C17H16N2 |
| Exact Mass | 248.131349 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 449fe3FsIOw |
|---|---|
| Name | 2-[(E)-1-(4-Methylphenyl)prop-1-en-2-yl]-1H-benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.131348523 u |
| Formula | C17H16N2 |
| InChI | InChI=1S/C17H16N2/c1-12-7-9-14(10-8-12)11-13(2)17-18-15-5-3-4-6-16(15)19-17/h3-11H,1-2H3,(H,18,19)/b13-11+ |
| InChIKey | NJPYDNHPRXDALE-ACCUITESSA-N |
| Molecular Weight | 248.329 g/mol |
| SMILES | C=1C=C2NC(\C(=C\C3=CC=C(C=C3)C)C)=NC2=CC1 |