| SpectraBase Compound ID | Dk5LXppVSW3 |
|---|---|
| InChI | InChI=1S/C6H10O2S/c1-4(7)6(9-3)5(2)8/h6H,1-3H3 |
| InChIKey | HTVGCUNUQZCFAN-UHFFFAOYSA-N |
| Mol Weight | 146.2 g/mol |
| Molecular Formula | C6H10O2S |
| Exact Mass | 146.040151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1hRNGKYF1bl |
|---|---|
| Name | 3-(Methylthio)penta-2,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.040150734 u |
| Formula | C6H10O2S |
| InChI | InChI=1S/C6H10O2S/c1-4(7)6(9-3)5(2)8/h6H,1-3H3 |
| InChIKey | HTVGCUNUQZCFAN-UHFFFAOYSA-N |
| Molecular Weight | 146.204 g/mol |
| SMILES | C(C(=O)C)(C(C)=O)SC |