| SpectraBase Compound ID | 1ylAVOW6RDM |
|---|---|
| InChI | InChI=1S/C12H11NOS/c1-9-7-8-15-11(9)12(14)13-10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14) |
| InChIKey | SXEXMROTXMWPPJ-UHFFFAOYSA-N |
| Mol Weight | 217.29 g/mol |
| Molecular Formula | C12H11NOS |
| Exact Mass | 217.056135 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7cEV6VrX5rw |
|---|---|
| Name | 3-Methylthiophene-2-carboxanilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.056135151 u |
| Formula | C12H11NOS |
| InChI | InChI=1S/C12H11NOS/c1-9-7-8-15-11(9)12(14)13-10-5-3-2-4-6-10/h2-8H,1H3,(H,13,14) |
| InChIKey | SXEXMROTXMWPPJ-UHFFFAOYSA-N |
| Molecular Weight | 217.286 g/mol |
| SMILES | C1(=C(C=CS1)C)C(=O)NC1=CC=CC=C1 |