| SpectraBase Compound ID | 2pOLEKnXuXK |
|---|---|
| InChI | InChI=1S/C9H11N3S/c1-2-6-11-9(13)12-8-5-3-4-7-10-8/h2-5,7H,1,6H2,(H2,10,11,12,13) |
| InChIKey | DYFDSHKKGBOHSZ-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 | KyRUN7aLljs |
|---|---|
| Name | 1-Allyl-3-(2-pyridyl)-2-thiourea |
| 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/c1-2-6-11-9(13)12-8-5-3-4-7-10-8/h2-5,7H,1,6H2,(H2,10,11,12,13) |
| InChIKey | DYFDSHKKGBOHSZ-UHFFFAOYSA-N |
| SMILES | N(C1=CC=CC=N1)C(NCC=C)=S |