| SpectraBase Compound ID | 3mw3JMXZ8c2 |
|---|---|
| InChI | InChI=1S/C11H7ClN2O3S/c12-8-3-1-2-4-9(8)13-11(15)7-5-10(14(16)17)18-6-7/h1-6H,(H,13,15) |
| InChIKey | OGBPTWCDBMQAFX-UHFFFAOYSA-N |
| Mol Weight | 282.7 g/mol |
| Molecular Formula | C11H7ClN2O3S |
| Exact Mass | 281.986591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5JqqR2XErgJ |
|---|---|
| Name | N-(2-Chlorophenyl)-5-nitro-3-thiophenecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.986590964 u |
| Formula | C11H7ClN2O3S |
| InChI | InChI=1S/C11H7ClN2O3S/c12-8-3-1-2-4-9(8)13-11(15)7-5-10(14(16)17)18-6-7/h1-6H,(H,13,15) |
| InChIKey | OGBPTWCDBMQAFX-UHFFFAOYSA-N |
| SMILES | C=1(C=C(N(=O)=O)SC1)C(NC=1C(Cl)=CC=CC1)=O |