![1H-benzimidazole, 2-[[(2-chlorophenyl)methyl]thio]-1-methyl-](/api/spectrum/GVKcOk7bGQX/structure.png?h=300&w=458 "1H-benzimidazole, 2-[[(2-chlorophenyl)methyl]thio]-1-methyl-")
| SpectraBase Compound ID | D03DWKADi5C |
|---|---|
| InChI | InChI=1S/C15H13ClN2S/c1-18-14-9-5-4-8-13(14)17-15(18)19-10-11-6-2-3-7-12(11)16/h2-9H,10H2,1H3 |
| InChIKey | NVYGKARQHVSBCW-UHFFFAOYSA-N |
| Mol Weight | 288.8 g/mol |
| Molecular Formula | C15H13ClN2S |
| Exact Mass | 288.048797 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GVKcOk7bGQX |
|---|---|
| Name | 1H-Benzimidazole, 2-[[(2-chlorophenyl)methyl]thio]-1-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.048797301 u |
| Formula | C15H13ClN2S |
| InChI | InChI=1S/C15H13ClN2S/c1-18-14-9-5-4-8-13(14)17-15(18)19-10-11-6-2-3-7-12(11)16/h2-9H,10H2,1H3 |
| InChIKey | NVYGKARQHVSBCW-UHFFFAOYSA-N |
| Molecular Weight | 288.796 g/mol |
| SMILES | C1(=NC=2C=CC=CC2N1C)SCC1=C(Cl)C=CC=C1 |