![2-[(2-methyl-2-propenyl)sulfanyl]-4,5-diphenyl-1H-imidazole](/api/spectrum/KWhIk6xllmS/structure.png?h=300&w=458 "2-[(2-methyl-2-propenyl)sulfanyl]-4,5-diphenyl-1H-imidazole")
| SpectraBase Compound ID | 6o1ruHqPuy8 |
|---|---|
| InChI | InChI=1S/C19H18N2S/c1-14(2)13-22-19-20-17(15-9-5-3-6-10-15)18(21-19)16-11-7-4-8-12-16/h3-12H,1,13H2,2H3,(H,20,21) |
| InChIKey | XSPNLEZSDDEPNB-UHFFFAOYSA-N |
| Mol Weight | 306.43 g/mol |
| Molecular Formula | C19H18N2S |
| Exact Mass | 306.11907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KWhIk6xllmS |
|---|---|
| Name | 2-[(2-Methyl-2-propenyl)sulfanyl]-4,5-diphenyl-1H-imidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.119069762 u |
| Formula | C19H18N2S |
| InChI | InChI=1S/C19H18N2S/c1-14(2)13-22-19-20-17(15-9-5-3-6-10-15)18(21-19)16-11-7-4-8-12-16/h3-12H,1,13H2,2H3,(H,20,21) |
| InChIKey | XSPNLEZSDDEPNB-UHFFFAOYSA-N |
| Molecular Weight | 306.427 g/mol |
| SMILES | N1C(=NC(=C1C=1C=CC=CC1)C=1C=CC=CC1)SCC(=C)C |