![1H-1,3-Benzimidazole, 2-[(1-methylpropyl)thio]-](/api/spectrum/8jA6wppgGGi/structure.png?h=300&w=458 "1H-1,3-Benzimidazole, 2-[(1-methylpropyl)thio]-")
| SpectraBase Compound ID | eqTlAVxLgb |
|---|---|
| InChI | InChI=1S/C11H14N2S/c1-3-8(2)14-11-12-9-6-4-5-7-10(9)13-11/h4-8H,3H2,1-2H3,(H,12,13) |
| InChIKey | DBVGJJQFZVPHHQ-UHFFFAOYSA-N |
| Mol Weight | 206.31 g/mol |
| Molecular Formula | C11H14N2S |
| Exact Mass | 206.08777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8jA6wppgGGi |
|---|---|
| Name | 1H-1,3-Benzimidazole, 2-[(1-methylpropyl)thio]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.087769633 u |
| Formula | C11H14N2S |
| InChI | InChI=1S/C11H14N2S/c1-3-8(2)14-11-12-9-6-4-5-7-10(9)13-11/h4-8H,3H2,1-2H3,(H,12,13) |
| InChIKey | DBVGJJQFZVPHHQ-UHFFFAOYSA-N |
| Molecular Weight | 206.307 g/mol |
| SMILES | C1=CC=C2C(=C1)N=C(N2)SC(C)CC |