| SpectraBase Compound ID | CoioMziRQeW |
|---|---|
| InChI | InChI=1S/C17H26O3/c1-11(18)20-10-12-8-13(16(2,3)4)15(19)14(9-12)17(5,6)7/h8-9,19H,10H2,1-7H3 |
| InChIKey | UJQUIYGYEMWYBS-UHFFFAOYSA-N |
| Mol Weight | 278.39 g/mol |
| Molecular Formula | C17H26O3 |
| Exact Mass | 278.188195 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fq3cQaJNIQD |
|---|---|
| Name | Benzenemethanol, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, .alpha.-acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.188194694 u |
| Formula | C17H26O3 |
| InChI | InChI=1S/C17H26O3/c1-11(18)20-10-12-8-13(16(2,3)4)15(19)14(9-12)17(5,6)7/h8-9,19H,10H2,1-7H3 |
| InChIKey | UJQUIYGYEMWYBS-UHFFFAOYSA-N |
| Molecular Weight | 278.392 g/mol |
| SMILES | C1=C(C=C(C(=C1C(C)(C)C)O)C(C)(C)C)COC(C)=O |