| SpectraBase Compound ID | 4MqXOC34v4V |
|---|---|
| InChI | InChI=1S/C11H12N2O2S/c1-2-9(10(14)15)16-11-12-7-5-3-4-6-8(7)13-11/h3-6,9H,2H2,1H3,(H,12,13)(H,14,15) |
| InChIKey | PUNPYITWFHQFFX-UHFFFAOYSA-N |
| Mol Weight | 236.29 g/mol |
| Molecular Formula | C11H12N2O2S |
| Exact Mass | 236.061949 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LxraGsCvnQ5 |
|---|---|
| Name | 2-(2-BENZIMIDAZOLYLTHIO)-BUTYRIC-ACID |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C11H12N2O2S |
| InChI | InChI=1S/C11H12N2O2S/c1-2-9(10(14)15)16-11-12-7-5-3-4-6-8(7)13-11/h3-6,9H,2H2,1H3,(H,12,13)(H,14,15) |
| InChIKey | PUNPYITWFHQFFX-UHFFFAOYSA-N |
| Literature Reference Author | M.KOOS |
| Literature Reference Citation | MH.CHEM.,125,1011(1994) |
| Literature Reference DOI | 10.1007/BF00812716 |
| Molecular Weight | 236.288 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPR1780 |