| SpectraBase Compound ID | anyNJZOKZA |
|---|---|
| InChI | InChI=1S/C16H32O/c1-12(2)8-7-9-14(5)10-11-16(13(3)4)15(6)17/h12-14,16H,7-11H2,1-6H3 |
| InChIKey | XCMBADWJWNQIAY-UHFFFAOYSA-N |
| Mol Weight | 240.4 g/mol |
| Molecular Formula | C16H32O |
| Exact Mass | 240.245316 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ka18LMOl52F |
|---|---|
| Name | 3-Isopropyl-6,10-dimethylundecane-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.245315649 u |
| Formula | C16H32O |
| InChI | InChI=1S/C16H32O/c1-12(2)8-7-9-14(5)10-11-16(13(3)4)15(6)17/h12-14,16H,7-11H2,1-6H3 |
| InChIKey | XCMBADWJWNQIAY-UHFFFAOYSA-N |
| Molecular Weight | 240.431 g/mol |
| SMILES | CC(C(CCC(CCCC(C)C)C)C(C)C)=O |