| SpectraBase Compound ID | S2QLA2u7Ne |
|---|---|
| InChI | InChI=1S/C7H12O/c1-3-7(2)5-4-6-8/h3,6-7H,1,4-5H2,2H3 |
| InChIKey | ONNBZNJCHJAMQS-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6mNiYg6zi24 |
|---|---|
| Name | 4-Methyl-5-hexenal |
| Alternate Name(s) | 4-Methylhex-5-enal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-3-7(2)5-4-6-8/h3,6-7H,1,4-5H2,2H3 |
| InChIKey | ONNBZNJCHJAMQS-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | C(CCC(C=C)C)=O |
| SPLASH | splash10-066r-9000000000-292f07af15014f984613 |
| Source of Spectrum | SO-0-1968-0 |
| Wiley ID | 878334 |