| SpectraBase Compound ID | 8Z651qd6n98 |
|---|---|
| InChI | InChI=1S/C15H24O3/c1-11(2)15(17)12(3)14(16)10-18-9-13-7-5-4-6-8-13/h4-8,11-12,14-17H,9-10H2,1-3H3 |
| InChIKey | XLNQOFWEJQJLFI-UHFFFAOYSA-N |
| Mol Weight | 252.35 g/mol |
| Molecular Formula | C15H24O3 |
| Exact Mass | 252.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KpmkAaaePkq |
|---|---|
| Name | 1-Benzyloxy-3,5-dimethyl-hexan-2,4-diol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.172544630 u |
| Formula | C15H24O3 |
| InChI | InChI=1S/C15H24O3/c1-11(2)15(17)12(3)14(16)10-18-9-13-7-5-4-6-8-13/h4-8,11-12,14-17H,9-10H2,1-3H3 |
| InChIKey | XLNQOFWEJQJLFI-UHFFFAOYSA-N |
| Molecular Weight | 252.354 g/mol |
| SMILES | C(C(C(C(C(C)C)O)C)O)OCC=1C=CC=CC1 |