| SpectraBase Compound ID | 97E8aufbu0Z |
|---|---|
| InChI | InChI=1S/C14H22O3/c1-10(12(3)16)8-9-14(4,5)13(17)7-6-11(2)15/h1,6-9H2,2-5H3 |
| InChIKey | UHSKQHGOGAPXJJ-UHFFFAOYSA-N |
| Mol Weight | 238.33 g/mol |
| Molecular Formula | C14H22O3 |
| Exact Mass | 238.156895 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IrRWYvEjxcM |
|---|---|
| Name | 6,6-Dimethyl-9-methylene-undecane-2,5,10-trione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.156894565 u |
| Formula | C14H22O3 |
| InChI | InChI=1S/C14H22O3/c1-10(12(3)16)8-9-14(4,5)13(17)7-6-11(2)15/h1,6-9H2,2-5H3 |
| InChIKey | UHSKQHGOGAPXJJ-UHFFFAOYSA-N |
| Molecular Weight | 238.327 g/mol |
| SMILES | C=C(C(C)=O)CCC(C(=O)CCC(C)=O)(C)C |