![1-Methyl-2-[.alpha.-(phenylthia)acetyl]benzimidazole](/api/spectrum/L5aRFmviHes/structure.png?h=300&w=458 "1-Methyl-2-[.alpha.-(phenylthia)acetyl]benzimidazole")
| SpectraBase Compound ID | Fc3GqcvGuce |
|---|---|
| InChI | InChI=1S/C16H14N2OS/c1-18-14-10-6-5-9-13(14)17-16(18)15(19)11-20-12-7-3-2-4-8-12/h2-10H,11H2,1H3 |
| InChIKey | PCMJMMCRCMOASR-UHFFFAOYSA-N |
| Mol Weight | 282.36 g/mol |
| Molecular Formula | C16H14N2OS |
| Exact Mass | 282.082684 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L5aRFmviHes |
|---|---|
| Name | 1-Methyl-2-[.alpha.-(phenylthia)acetyl]benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.082684252 u |
| Formula | C16H14N2OS |
| InChI | InChI=1S/C16H14N2OS/c1-18-14-10-6-5-9-13(14)17-16(18)15(19)11-20-12-7-3-2-4-8-12/h2-10H,11H2,1H3 |
| InChIKey | PCMJMMCRCMOASR-UHFFFAOYSA-N |
| SMILES | C=1C=C2C(=CC1)N=C(C(=O)CSC1=CC=CC=C1)N2C |