| SpectraBase Compound ID | 9Y9QbvT50gq |
|---|---|
| InChI | InChI=1S/C14H24O3/c1-10(12(3)16)9-13(17)14(4,5)8-6-7-11(2)15/h10H,6-9H2,1-5H3 |
| InChIKey | MOTKFTIYHVKXLB-UHFFFAOYSA-N |
| Mol Weight | 240.34 g/mol |
| Molecular Formula | C14H24O3 |
| Exact Mass | 240.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2NbQDe1zOcd |
|---|---|
| Name | 3,6,6-Trimethylundecane-2,5,10-trione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.172544630 u |
| Formula | C14H24O3 |
| InChI | InChI=1S/C14H24O3/c1-10(12(3)16)9-13(17)14(4,5)8-6-7-11(2)15/h10H,6-9H2,1-5H3 |
| InChIKey | MOTKFTIYHVKXLB-UHFFFAOYSA-N |
| Molecular Weight | 240.343 g/mol |
| SMILES | C(=O)(C(C)(CCCC(C)=O)C)CC(C)C(C)=O |