| SpectraBase Compound ID | EU9eUJpl32y |
|---|---|
| InChI | InChI=1S/C7H12O/c1-4-5-6(2)7(3)8/h4,6H,1,5H2,2-3H3 |
| InChIKey | JIQZYDBOQOYECI-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 | 9oNpgNmr0vq |
|---|---|
| Name | 3-Methyl-5-hexen-2-one |
| Alternate Name(s) | 3-Methylhex-5-en-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-4-5-6(2)7(3)8/h4,6H,1,5H2,2-3H3 |
| InChIKey | JIQZYDBOQOYECI-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | C(=O)(C(CC=C)C)C |
| SPLASH | splash10-0006-9000000000-8bb7b45c6f54b4fef0cd |
| Source of Spectrum | RB-1982-9686-0 |
| Wiley ID | 1123322 |