| SpectraBase Compound ID | Glw9NzP5Zy1 |
|---|---|
| InChI | InChI=1S/C13H11ClN2O2S/c1-7(17)16-10-6-11(19-12(10)13(15)18)8-2-4-9(14)5-3-8/h2-6H,1H3,(H2,15,18)(H,16,17) |
| InChIKey | LXJTUVQFXBOFQF-UHFFFAOYSA-N |
| Mol Weight | 294.76 g/mol |
| Molecular Formula | C13H11ClN2O2S |
| Exact Mass | 294.022976 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H7pCxZcaMUT |
|---|---|
| Name | 3-Amino-5-(4-chlorophenyl)thiophene-2-carboxamide, N-acetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.022976474 u |
| Formula | C13H11ClN2O2S |
| InChI | InChI=1S/C13H11ClN2O2S/c1-7(17)16-10-6-11(19-12(10)13(15)18)8-2-4-9(14)5-3-8/h2-6H,1H3,(H2,15,18)(H,16,17) |
| InChIKey | LXJTUVQFXBOFQF-UHFFFAOYSA-N |
| Molecular Weight | 294.756 g/mol |
| SMILES | C=1(SC(=C(C1)NC(=O)C)C(=O)N)C1=CC=C(C=C1)Cl |