| SpectraBase Compound ID | 6id29WBekuV |
|---|---|
| InChI | InChI=1S/C11H18O2/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h2,6,10H,3-5,7-9H2,1H3/b6-2+ |
| InChIKey | HWGHMAZMJNXVPA-QHHAFSJGSA-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 | JHgixCViMlv |
|---|---|
| Name | 2-Butenoic acid, cyclohexylmethyl 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/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h2,6,10H,3-5,7-9H2,1H3/b6-2+ |
| InChIKey | HWGHMAZMJNXVPA-QHHAFSJGSA-N |
| Molecular Weight | 182.263 g/mol |
| SMILES | C(\C=C\C)(=O)OCC1CCCCC1 |