| SpectraBase Compound ID | AIUOecdqFAp |
|---|---|
| InChI | InChI=1S/C6H12OS/c1-6(5-7)3-4-8-2/h5-6H,3-4H2,1-2H3 |
| InChIKey | YFQSMDALFDUXFD-UHFFFAOYSA-N |
| Mol Weight | 132.22 g/mol |
| Molecular Formula | C6H12OS |
| Exact Mass | 132.060886 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DyFeqxzEizN |
|---|---|
| Name | 2-Methyl-4-methylthiobutanal and 5-methylthiopentanal |
| Alternate Name(s) | 2-Methyl-4-(methylsulfanyl)butanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H12OS |
| InChI | InChI=1S/C6H12OS/c1-6(5-7)3-4-8-2/h5-6H,3-4H2,1-2H3 |
| InChIKey | YFQSMDALFDUXFD-UHFFFAOYSA-N |
| Molecular Weight | 132.221 g/mol |
| SMILES | C(=O)C(CCSC)C |
| SPLASH | splash10-08fr-9100000000-75c3a517638b78682869 |
| Source of Spectrum | B-46-995-0 |
| Wiley ID | 1133698 |