| SpectraBase Compound ID | GwGvhjUATHY |
|---|---|
| InChI | InChI=1S/C5H11NS/c1-2-3-4-5(6)7/h2-4H2,1H3,(H2,6,7) |
| InChIKey | FFXIGVUMVPUWDK-UHFFFAOYSA-N |
| Mol Weight | 117.21 g/mol |
| Molecular Formula | C5H11NS |
| Exact Mass | 117.061221 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GB1Y57sdXPV |
|---|---|
| Name | Pentanethioamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 117.061220532 u |
| Formula | C5H11NS |
| InChI | InChI=1S/C5H11NS/c1-2-3-4-5(6)7/h2-4H2,1H3,(H2,6,7) |
| InChIKey | FFXIGVUMVPUWDK-UHFFFAOYSA-N |
| Molecular Weight | 117.210 g/mol |
| SMILES | C(CCCC)(N)=S |