| SpectraBase Compound ID | 13Bh62c8XK8 |
|---|---|
| InChI | InChI=1S/C16H13ClN2OS/c1-2-21-16-18-13-5-3-4-6-14(13)19(16)15(20)11-7-9-12(17)10-8-11/h3-10H,2H2,1H3 |
| InChIKey | UEWAQCDIPUULSX-UHFFFAOYSA-N |
| Mol Weight | 316.81 g/mol |
| Molecular Formula | C16H13ClN2OS |
| Exact Mass | 316.043712 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cbm3BcMuzd0 |
|---|---|
| Name | Methanone, (4-chlorophenyl)(2-ethylthio-1-benzimidazolyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.043711920 u |
| Formula | C16H13ClN2OS |
| InChI | InChI=1S/C16H13ClN2OS/c1-2-21-16-18-13-5-3-4-6-14(13)19(16)15(20)11-7-9-12(17)10-8-11/h3-10H,2H2,1H3 |
| InChIKey | UEWAQCDIPUULSX-UHFFFAOYSA-N |
| Molecular Weight | 316.806 g/mol |
| SMILES | C1=CC=C2N(C(=NC2=C1)SCC)C(C1=CC=C(C=C1)Cl)=O |