| SpectraBase Compound ID | AEtgr5oa67F |
|---|---|
| InChI | InChI=1S/C20H16N2S/c1-2-8-16(9-3-1)19-13-21-20(22-19)23-14-17-11-6-10-15-7-4-5-12-18(15)17/h1-13H,14H2,(H,21,22) |
| InChIKey | VFJRCKQDZCBVCY-UHFFFAOYSA-N |
| Mol Weight | 316.42 g/mol |
| Molecular Formula | C20H16N2S |
| Exact Mass | 316.10342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IXWgdcGPSIk |
|---|---|
| Name | Imidazole, 2-(1-naphthylmethylthio)-4-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.103419697 u |
| Formula | C20H16N2S |
| InChI | InChI=1S/C20H16N2S/c1-2-8-16(9-3-1)19-13-21-20(22-19)23-14-17-11-6-10-15-7-4-5-12-18(15)17/h1-13H,14H2,(H,21,22) |
| InChIKey | VFJRCKQDZCBVCY-UHFFFAOYSA-N |
| Molecular Weight | 316.422 g/mol |
| SMILES | C1=CC=C(C=C1)C=1N=C(NC1)SCC=1C=2C(=CC=CC2)C=CC1 |