| SpectraBase Compound ID | JNpfXcf7gYA |
|---|---|
| InChI | InChI=1S/C9H7Cl2N3S2/c10-6-2-1-5(3-7(6)11)4-15-9-14-13-8(12)16-9/h1-3H,4H2,(H2,12,13) |
| InChIKey | CWHKSVGUSBSCQP-UHFFFAOYSA-N |
| Mol Weight | 292.2 g/mol |
| Molecular Formula | C9H7Cl2N3S2 |
| Exact Mass | 290.945845 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | APEcMXSDplo |
|---|---|
| Name | 1,3,4-Thiadiazol-2-amine, 5-(3,4-dichlorobenzylthio)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.945844985 u |
| Formula | C9H7Cl2N3S2 |
| InChI | InChI=1S/C9H7Cl2N3S2/c10-6-2-1-5(3-7(6)11)4-15-9-14-13-8(12)16-9/h1-3H,4H2,(H2,12,13) |
| InChIKey | CWHKSVGUSBSCQP-UHFFFAOYSA-N |
| Molecular Weight | 292.202 g/mol |
| SMILES | C1=CC(Cl)=C(C=C1CSC=1SC(N)=NN1)Cl |