| SpectraBase Compound ID | LwPFuc090YY |
|---|---|
| InChI | InChI=1S/C12H10N2O2S2/c1-18-12(17)14-11(16)10(15)8-6-13-9-5-3-2-4-7(8)9/h2-6,13H,1H3,(H,14,16,17) |
| InChIKey | QAYZTQVHIWOVHN-UHFFFAOYSA-N |
| Mol Weight | 278.34 g/mol |
| Molecular Formula | C12H10N2O2S2 |
| Exact Mass | 278.01837 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6QCa2SNyDtP |
|---|---|
| Name | Methyl 2-(1H-indol-3-yl)-2-oxoacetylcarbamodithioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.018369916 u |
| Formula | C12H10N2O2S2 |
| InChI | InChI=1S/C12H10N2O2S2/c1-18-12(17)14-11(16)10(15)8-6-13-9-5-3-2-4-7(8)9/h2-6,13H,1H3,(H,14,16,17) |
| InChIKey | QAYZTQVHIWOVHN-UHFFFAOYSA-N |
| SMILES | C=1C=C2C(=CNC2=CC1)C(C(=O)NC(=S)SC)=O |