| SpectraBase Compound ID | FRsDU4hCenh |
|---|---|
| InChI | InChI=1S/C19H30O2/c20-18(17-4-2-1-3-5-17)21-7-6-19-11-14-8-15(12-19)10-16(9-14)13-19/h14-17H,1-13H2/t14-,15+,16-,19+ |
| InChIKey | GFOPWEUURBNRJY-IAKCYEPBSA-N |
| Mol Weight | 290.45 g/mol |
| Molecular Formula | C19H30O2 |
| Exact Mass | 290.22458 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7sRI6H1EQEq |
|---|---|
| Name | Cyclohexanecarboxylic acid, 2-(1-adamantyl)ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.224580204 u |
| Formula | C19H30O2 |
| InChI | InChI=1S/C19H30O2/c20-18(17-4-2-1-3-5-17)21-7-6-19-11-14-8-15(12-19)10-16(9-14)13-19/h14-17H,1-13H2/t14-,15+,16-,19+ |
| InChIKey | GFOPWEUURBNRJY-IAKCYEPBSA-N |
| SMILES | [C@]12(CC3(C[C@](C2)(C[C@](C1)(C3)[H])[H])CCOC(=O)C1CCCCC1)[H] |