| SpectraBase Compound ID | 84Q9hGuGr3s |
|---|---|
| InChI | InChI=1S/C12H26/c1-10(2)6-8-12(5)9-7-11(3)4/h10-12H,6-9H2,1-5H3 |
| InChIKey | YYZRNFMGAQMLJJ-UHFFFAOYSA-N |
| Mol Weight | 170.34 g/mol |
| Molecular Formula | C12H26 |
| Exact Mass | 170.203451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A8m6VKPsn8l |
|---|---|
| Name | 2,5,8-Trimethylnonane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.203450837 u |
| Formula | C12H26 |
| InChI | InChI=1S/C12H26/c1-10(2)6-8-12(5)9-7-11(3)4/h10-12H,6-9H2,1-5H3 |
| InChIKey | YYZRNFMGAQMLJJ-UHFFFAOYSA-N |
| Molecular Weight | 170.340 g/mol |
| SMILES | CC(CCC(CCC(C)C)C)C |