| SpectraBase Compound ID | I80ZBu91c0G |
|---|---|
| InChI | InChI=1S/C7H8ClN3S/c8-5-2-1-3-6(4-5)10-7(12)11-9/h1-4H,9H2,(H2,10,11,12) |
| InChIKey | YUSLJYYTYKWSHL-UHFFFAOYSA-N |
| Mol Weight | 201.68 g/mol |
| Molecular Formula | C7H8ClN3S |
| Exact Mass | 201.012746 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3y5uNRNfFeC |
|---|---|
| Name | 4-(3-Chlorophenyl)-3-thiosemicarbazide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.012746144 u |
| Formula | C7H8ClN3S |
| InChI | InChI=1S/C7H8ClN3S/c8-5-2-1-3-6(4-5)10-7(12)11-9/h1-4H,9H2,(H2,10,11,12) |
| InChIKey | YUSLJYYTYKWSHL-UHFFFAOYSA-N |
| SMILES | N(C=1C=C(C=CC1)Cl)C(=S)NN |