| SpectraBase Compound ID | J98uXrT26hs |
|---|---|
| InChI | InChI=1S/C11H18O2/c1-9(11(12)13-2)8-10-6-4-3-5-7-10/h10H,1,3-8H2,2H3 |
| InChIKey | GGYYTUNTDIAOQT-UHFFFAOYSA-N |
| Mol Weight | 182.26 g/mol |
| Molecular Formula | C11H18O2 |
| Exact Mass | 182.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3u90abFP01l |
|---|---|
| Name | Cyclohexanepropanoic acid, .alpha.-methylene-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.130679818 u |
| Formula | C11H18O2 |
| InChI | InChI=1S/C11H18O2/c1-9(11(12)13-2)8-10-6-4-3-5-7-10/h10H,1,3-8H2,2H3 |
| InChIKey | GGYYTUNTDIAOQT-UHFFFAOYSA-N |
| Molecular Weight | 182.263 g/mol |
| SMILES | C(C(=O)OC)(CC1CCCCC1)=C |