| SpectraBase Compound ID | 5pf2szEEl8z |
|---|---|
| InChI | InChI=1S/C9H11N3S/c1-12(9(10)13)11-7-8-5-3-2-4-6-8/h2-7H,1H3,(H2,10,13) |
| InChIKey | CQRRYFDERNDLSA-UHFFFAOYSA-N |
| Mol Weight | 193.27 g/mol |
| Molecular Formula | C9H11N3S |
| Exact Mass | 193.067369 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KsZxycetWVa |
|---|---|
| Name | 2-Benzylidene-1-methylhydrazinecarbothioamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.067368540 u |
| Formula | C9H11N3S |
| InChI | InChI=1S/C9H11N3S/c1-12(9(10)13)11-7-8-5-3-2-4-6-8/h2-7H,1H3,(H2,10,13) |
| InChIKey | CQRRYFDERNDLSA-UHFFFAOYSA-N |
| Molecular Weight | 193.268 g/mol |
| SMILES | C=1(\C=N\N(C(N)=S)C)C=CC=CC1 |