| SpectraBase Compound ID | E5PLMqQ0qz9 |
|---|---|
| InChI | InChI=1S/C15H26O3/c1-15(2,3)14(17)18-10-5-4-7-12-8-6-9-13(16)11-12/h12H,4-11H2,1-3H3 |
| InChIKey | INOXFBFZOXBYMQ-UHFFFAOYSA-N |
| Mol Weight | 254.37 g/mol |
| Molecular Formula | C15H26O3 |
| Exact Mass | 254.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CMwVMgRtYbj |
|---|---|
| Name | 2,2-Dimethylpropanoic acid 4-(3-oxocyclohexyl)butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.188194694 u |
| Formula | C15H26O3 |
| InChI | InChI=1S/C15H26O3/c1-15(2,3)14(17)18-10-5-4-7-12-8-6-9-13(16)11-12/h12H,4-11H2,1-3H3 |
| InChIKey | INOXFBFZOXBYMQ-UHFFFAOYSA-N |
| Molecular Weight | 254.370 g/mol |
| SMILES | C(C(C)(C)C)(=O)OCCCCC1CC(=O)CCC1 |