| SpectraBase Compound ID | JNzIXg4hRwM |
|---|---|
| InChI | InChI=1S/C8H12O3/c1-6(2)4-7(9)5-8(10)11-3/h4H,5H2,1-3H3 |
| InChIKey | BRUOTCVCYPVYPM-UHFFFAOYSA-N |
| Mol Weight | 156.18 g/mol |
| Molecular Formula | C8H12O3 |
| Exact Mass | 156.078644 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DLIYFkcO7j9 |
|---|---|
| Name | Methyl 5-methyl-3-keto-4-hexenoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O3 |
| InChI | InChI=1S/C8H12O3/c1-6(2)4-7(9)5-8(10)11-3/h4H,5H2,1-3H3 |
| InChIKey | BRUOTCVCYPVYPM-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 156.181 g/mol |
| SMILES | COC(=O)CC(=O)C=C(C)C |
| SPLASH | splash10-001i-9000000000-2b1cf8fb0de8cce10345 |
| Source of Spectrum | SRH-2022-4746-0 |
| Wiley ID | 1826877 |