| SpectraBase Compound ID | HgT0FoC0Ol0 |
|---|---|
| InChI | InChI=1S/C14H20O2/c1-5-16-13(15)12(14(2,3)4)11-9-7-6-8-10-11/h6-10,12H,5H2,1-4H3 |
| InChIKey | IKVNZMMEYTVOOP-UHFFFAOYSA-N |
| Mol Weight | 220.31 g/mol |
| Molecular Formula | C14H20O2 |
| Exact Mass | 220.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KNS1yIfVvx3 |
|---|---|
| Name | Ethyl 3,3-dimethyl-2-phenylbutanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.146329882 u |
| Formula | C14H20O2 |
| InChI | InChI=1S/C14H20O2/c1-5-16-13(15)12(14(2,3)4)11-9-7-6-8-10-11/h6-10,12H,5H2,1-4H3 |
| InChIKey | IKVNZMMEYTVOOP-UHFFFAOYSA-N |
| Molecular Weight | 220.312 g/mol |
| SMILES | C(C(C(C)(C)C)C=1C=CC=CC1)(=O)OCC |