| SpectraBase Compound ID | KnoabUQaQRy |
|---|---|
| InChI | InChI=1S/C10H16O4/c1-7(2)6-14-10(13)5-9(12)4-8(3)11/h7H,4-6H2,1-3H3 |
| InChIKey | SXWMYAVRSPCEJD-UHFFFAOYSA-N |
| Mol Weight | 200.23 g/mol |
| Molecular Formula | C10H16O4 |
| Exact Mass | 200.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Kvg99YaxOMv |
|---|---|
| Name | Isobutyl 3,5-dioxohexanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.104858991 u |
| Formula | C10H16O4 |
| InChI | InChI=1S/C10H16O4/c1-7(2)6-14-10(13)5-9(12)4-8(3)11/h7H,4-6H2,1-3H3 |
| InChIKey | SXWMYAVRSPCEJD-UHFFFAOYSA-N |
| Molecular Weight | 200.234 g/mol |
| SMILES | C(=O)(CC(=O)CC(OCC(C)C)=O)C |