![Benzimidazole, 2-[2-(4-chlorophenoxy)ethylthio]-1-ethyl-](/api/spectrum/KqxZb5khDJZ/structure.png?h=300&w=458 "Benzimidazole, 2-[2-(4-chlorophenoxy)ethylthio]-1-ethyl-")
| SpectraBase Compound ID | 34zBcLt53mi |
|---|---|
| InChI | InChI=1S/C17H17ClN2OS/c1-2-20-16-6-4-3-5-15(16)19-17(20)22-12-11-21-14-9-7-13(18)8-10-14/h3-10H,2,11-12H2,1H3 |
| InChIKey | VQWATLZUSQKCAJ-UHFFFAOYSA-N |
| Mol Weight | 332.85 g/mol |
| Molecular Formula | C17H17ClN2OS |
| Exact Mass | 332.075012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KqxZb5khDJZ |
|---|---|
| Name | Benzimidazole, 2-[2-(4-chlorophenoxy)ethylthio]-1-ethyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.075012048 u |
| Formula | C17H17ClN2OS |
| InChI | InChI=1S/C17H17ClN2OS/c1-2-20-16-6-4-3-5-15(16)19-17(20)22-12-11-21-14-9-7-13(18)8-10-14/h3-10H,2,11-12H2,1H3 |
| InChIKey | VQWATLZUSQKCAJ-UHFFFAOYSA-N |
| Molecular Weight | 332.849 g/mol |
| SMILES | C1(=NC=2C=CC=CC2N1CC)SCCOC=1C=CC(=CC1)Cl |