| SpectraBase Compound ID | CLfNwqBQVp2 |
|---|---|
| InChI | InChI=1S/C10H12N4OS/c1-2-5-12-10(16)14-13-9(15)8-3-6-11-7-4-8/h2-4,6-7H,1,5H2,(H,13,15)(H2,12,14,16) |
| InChIKey | CYUACCRSZOJABF-UHFFFAOYSA-N |
| Mol Weight | 236.29 g/mol |
| Molecular Formula | C10H12N4OS |
| Exact Mass | 236.073182 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JEpBGQXfSB1 |
|---|---|
| Name | 4-Allyl-1-isonicotinoyl-3-thiosemicarbazide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.073182195 u |
| Formula | C10H12N4OS |
| InChI | InChI=1S/C10H12N4OS/c1-2-5-12-10(16)14-13-9(15)8-3-6-11-7-4-8/h2-4,6-7H,1,5H2,(H,13,15)(H2,12,14,16) |
| InChIKey | CYUACCRSZOJABF-UHFFFAOYSA-N |
| Molecular Weight | 236.293 g/mol |
| SMILES | N(C(C1=CC=NC=C1)=O)NC(NCC=C)=S |