| SpectraBase Compound ID | 7Wm59FNtscl |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-6(3-4-8)5-7(2)9/h4,6H,3,5H2,1-2H3 |
| InChIKey | YSJGFZKUCZEJSW-UHFFFAOYSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2g5ZgSVywy |
|---|---|
| Name | 3-Methyl-5-ketohexanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-6(3-4-8)5-7(2)9/h4,6H,3,5H2,1-2H3 |
| InChIKey | YSJGFZKUCZEJSW-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 128.171 g/mol |
| SMILES | C(=O)CC(C)CC(C)=O |
| SPLASH | splash10-0673-9200000000-55b46ee414d7252fe3d0 |
| Source of Spectrum | SRH-2022-2300-0 |
| Synonyms | 3-Methyl-5-oxohexanal |
| Wiley ID | 1824659 |