| SpectraBase Compound ID | 6uImOYu433c |
|---|---|
| InChI | InChI=1S/C14H22O2/c1-9(2)16-13(15)14-6-10-3-11(7-14)5-12(4-10)8-14/h9-12H,3-8H2,1-2H3/t10-,11+,12-,14- |
| InChIKey | PHSXMXGYVSYRPF-XDCQQTESSA-N |
| Mol Weight | 222.33 g/mol |
| Molecular Formula | C14H22O2 |
| Exact Mass | 222.16198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | ISUcnaCWJfY |
|---|---|
| Name | 1-Adamantanecarboxylic acid, isopropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.161979946 u |
| Formula | C14H22O2 |
| InChI | InChI=1S/C14H22O2/c1-9(2)16-13(15)14-6-10-3-11(7-14)5-12(4-10)8-14/h9-12H,3-8H2,1-2H3/t10-,11+,12-,14- |
| InChIKey | PHSXMXGYVSYRPF-XDCQQTESSA-N |
| Molecular Weight | 222.328 g/mol |
| SMILES | C1C2(C[C@]3(C[C@@]1(C[C@@](C2)(C3)[H])[H])[H])C(=O)OC(C)C |