| SpectraBase Compound ID | EP1fRNANqsf |
|---|---|
| InChI | InChI=1S/C7H10ClN3OS/c1-3-5-10-11-7(13-5)9-6(12)4(2)8/h4H,3H2,1-2H3,(H,9,11,12) |
| InChIKey | OTRRQPRHLHNAKR-UHFFFAOYSA-N |
| Mol Weight | 219.69 g/mol |
| Molecular Formula | C7H10ClN3OS |
| Exact Mass | 219.023311 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6cngUWeEPu5 |
|---|---|
| Name | 2-Chloro-N-(5-ethyl-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 | 219.023310827 u |
| Formula | C7H10ClN3OS |
| InChI | InChI=1S/C7H10ClN3OS/c1-3-5-10-11-7(13-5)9-6(12)4(2)8/h4H,3H2,1-2H3,(H,9,11,12) |
| InChIKey | OTRRQPRHLHNAKR-UHFFFAOYSA-N |
| Molecular Weight | 219.690 g/mol |
| SMILES | C(C(C)Cl)(=O)NC=1SC(CC)=NN1 |