| SpectraBase Compound ID | lkMXXQmgTd |
|---|---|
| InChI | InChI=1S/C11H9Cl2N3OS/c12-6-5-9(17)14-11-16-15-10(18-11)7-1-3-8(13)4-2-7/h1-4H,5-6H2,(H,14,16,17) |
| InChIKey | UREOKMZTWCFTHW-UHFFFAOYSA-N |
| Mol Weight | 302.18 g/mol |
| Molecular Formula | C11H9Cl2N3OS |
| Exact Mass | 300.984338 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Uy8Jr5u0q3 |
|---|---|
| Name | 3-Chloro-N-(5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl)propanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.984338495 u |
| Formula | C11H9Cl2N3OS |
| InChI | InChI=1S/C11H9Cl2N3OS/c12-6-5-9(17)14-11-16-15-10(18-11)7-1-3-8(13)4-2-7/h1-4H,5-6H2,(H,14,16,17) |
| InChIKey | UREOKMZTWCFTHW-UHFFFAOYSA-N |
| Molecular Weight | 302.179 g/mol |
| SMILES | C=1(SC(=NN1)C1=CC=C(C=C1)Cl)NC(CCCl)=O |