| SpectraBase Compound ID | 9y5C99vzxp1 |
|---|---|
| InChI | InChI=1S/C9H10N2S/c1-2-12-9-10-7-5-3-4-6-8(7)11-9/h3-6H,2H2,1H3,(H,10,11) |
| InChIKey | UGCOPUIBNABIEP-UHFFFAOYSA-N |
| Mol Weight | 178.25 g/mol |
| Molecular Formula | C9H10N2S |
| Exact Mass | 178.05647 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IXHoWnA5cxz |
|---|---|
| Name | 2-(Ethylsulfanyl)-1H-benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.056469504 u |
| Formula | C9H10N2S |
| InChI | InChI=1S/C9H10N2S/c1-2-12-9-10-7-5-3-4-6-8(7)11-9/h3-6H,2H2,1H3,(H,10,11) |
| InChIKey | UGCOPUIBNABIEP-UHFFFAOYSA-N |
| Molecular Weight | 178.253 g/mol |
| SMILES | C(SC=1NC2=C(N1)C=CC=C2)C |