| SpectraBase Compound ID | 79hty9EklbH |
|---|---|
| InChI | InChI=1S/C13H20O2/c1-2-15-13(14)12-10-4-8-3-9(6-10)7-11(12)5-8/h8-12H,2-7H2,1H3/t8-,9+,10-,11+,12? |
| InChIKey | VYLWDQILLRTFOG-ORZCXNSNSA-N |
| Mol Weight | 208.3 g/mol |
| Molecular Formula | C13H20O2 |
| Exact Mass | 208.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3I1aPfQyDo8 |
|---|---|
| Name | Ethyl adamantane-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.146329882 u |
| Formula | C13H20O2 |
| InChI | InChI=1S/C13H20O2/c1-2-15-13(14)12-10-4-8-3-9(6-10)7-11(12)5-8/h8-12H,2-7H2,1H3/t8-,9+,10-,11+,12? |
| InChIKey | VYLWDQILLRTFOG-ORZCXNSNSA-N |
| Molecular Weight | 208.301 g/mol |
| SMILES | [C@]12(C([C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])C(=O)OCC)[H] |