| SpectraBase Compound ID | JUSLG5ya9mo |
|---|---|
| InChI | InChI=1S/C9H12N2O2S2/c1-7-3-5-8(6-4-7)15(12,13)11-9(10)14-2/h3-6H,1-2H3,(H2,10,11) |
| InChIKey | ZWAMEGGTEJHAOT-UHFFFAOYSA-N |
| Mol Weight | 244.33 g/mol |
| Molecular Formula | C9H12N2O2S2 |
| Exact Mass | 244.03402 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8O7fzPGe2to |
|---|---|
| Name | Methyl N'-tosylcarbamimidothioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.034019980 u |
| Formula | C9H12N2O2S2 |
| InChI | InChI=1S/C9H12N2O2S2/c1-7-3-5-8(6-4-7)15(12,13)11-9(10)14-2/h3-6H,1-2H3,(H2,10,11) |
| InChIKey | ZWAMEGGTEJHAOT-UHFFFAOYSA-N |
| Molecular Weight | 244.327 g/mol |
| SMILES | CC1=CC=C(S(\N=C\(SC)N)(=O)=O)C=C1 |