| SpectraBase Compound ID | 6blxFEoskel |
|---|---|
| InChI | InChI=1S/C18H18N2S/c1-3-11-20-17-10-5-4-9-16(17)19-18(20)21-13-15-8-6-7-14(2)12-15/h3-10,12H,1,11,13H2,2H3 |
| InChIKey | DHUANQLATYSHQQ-UHFFFAOYSA-N |
| Mol Weight | 294.42 g/mol |
| Molecular Formula | C18H18N2S |
| Exact Mass | 294.11907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J5GkNBdKYLH |
|---|---|
| Name | 1-Allyl-2-(m-tolylmethylsulfanyl)benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.119069762 u |
| Formula | C18H18N2S |
| InChI | InChI=1S/C18H18N2S/c1-3-11-20-17-10-5-4-9-16(17)19-18(20)21-13-15-8-6-7-14(2)12-15/h3-10,12H,1,11,13H2,2H3 |
| InChIKey | DHUANQLATYSHQQ-UHFFFAOYSA-N |
| Molecular Weight | 294.416 g/mol |
| SMILES | C1(=NC2=CC=CC=C2N1CC=C)SCC=1C=C(C)C=CC1 |