| SpectraBase Compound ID | 9HXT0aq2JGv |
|---|---|
| InChI | InChI=1S/C15H26O2/c1-11(2)5-4-6-12(3)13-7-9-14(10-8-13)15(16)17/h9,11-13H,4-8,10H2,1-3H3,(H,16,17) |
| InChIKey | HWVPEEUATUWPLD-UHFFFAOYSA-N |
| Mol Weight | 238.37 g/mol |
| Molecular Formula | C15H26O2 |
| Exact Mass | 238.19328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1zCpmP7ftWe |
|---|---|
| Name | (R-(R*,R*))-4-(1,5-dimethylhexyl)-1-cyclohexenecarboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.193280075 u |
| Formula | C15H26O2 |
| InChI | InChI=1S/C15H26O2/c1-11(2)5-4-6-12(3)13-7-9-14(10-8-13)15(16)17/h9,11-13H,4-8,10H2,1-3H3,(H,16,17) |
| InChIKey | HWVPEEUATUWPLD-UHFFFAOYSA-N |
| Molecular Weight | 238.371 g/mol |
| SMILES | C1(=CCC(CC1)C(C)CCCC(C)C)C(O)=O |