| SpectraBase Compound ID | DTltr3JzXwN |
|---|---|
| InChI | InChI=1S/C19H24O2/c1-12-3-13(2)5-17(4-12)21-18(20)19-9-14-6-15(10-19)8-16(7-14)11-19/h3-5,14-16H,6-11H2,1-2H3/t14-,15+,16-,19- |
| InChIKey | FQRPDLFZZYNVAZ-HGYGSNGRSA-N |
| Mol Weight | 284.4 g/mol |
| Molecular Formula | C19H24O2 |
| Exact Mass | 284.17763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6vI7bor2go7 |
|---|---|
| Name | 1-Adamantanecarboxylic acid, 3,5-dimethylphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.177630011 u |
| Formula | C19H24O2 |
| InChI | InChI=1S/C19H24O2/c1-12-3-13(2)5-17(4-12)21-18(20)19-9-14-6-15(10-19)8-16(7-14)11-19/h3-5,14-16H,6-11H2,1-2H3/t14-,15+,16-,19- |
| InChIKey | FQRPDLFZZYNVAZ-HGYGSNGRSA-N |
| SMILES | C1[C@]2(C[C@]3(CC1(C[C@@](C2)(C3)[H])C(=O)OC1=CC(C)=CC(C)=C1)[H])[H] |