| SpectraBase Compound ID | 5hspsEDVlAF |
|---|---|
| InChI | InChI=1S/C8H14O3/c1-6(2)11-8(10)5-4-7(3)9/h6H,4-5H2,1-3H3 |
| InChIKey | MGJRGGIHFUREHT-UHFFFAOYSA-N |
| Mol Weight | 158.2 g/mol |
| Molecular Formula | C8H14O3 |
| Exact Mass | 158.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HQStNb4ge0t |
|---|---|
| Name | Isopropyl 4-oxopentanoate |
| Alternate Name(s) | Isopropyl levulinate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H14O3 |
| InChI | InChI=1S/C8H14O3/c1-6(2)11-8(10)5-4-7(3)9/h6H,4-5H2,1-3H3 |
| InChIKey | MGJRGGIHFUREHT-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 158.197 g/mol |
| SMILES | CC(=O)CCC(=O)OC(C)C |
| SPLASH | splash10-0007-9000000000-1107cc19dfacae79fde9 |
| Source of Spectrum | SRH-2022-9233-0 |
| Wiley ID | 1830904 |