| SpectraBase Compound ID | CwiC5W46EBS |
|---|---|
| InChI | InChI=1S/C16H24O3/c1-3-5-6-7-8-9-15(17)14-11-10-13(19-4-2)12-16(14)18/h10-12,18H,3-9H2,1-2H3 |
| InChIKey | DECLJLXWJMFGNK-UHFFFAOYSA-N |
| Mol Weight | 264.36 g/mol |
| Molecular Formula | C16H24O3 |
| Exact Mass | 264.172545 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cbtw7Ub7dxO |
|---|---|
| Name | 4'-Ethoxy-2'-hydroxyoctanophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.172544630 u |
| Formula | C16H24O3 |
| InChI | InChI=1S/C16H24O3/c1-3-5-6-7-8-9-15(17)14-11-10-13(19-4-2)12-16(14)18/h10-12,18H,3-9H2,1-2H3 |
| InChIKey | DECLJLXWJMFGNK-UHFFFAOYSA-N |
| Molecular Weight | 264.365 g/mol |
| SMILES | C1(=C(C=C(C=C1)OCC)O)C(=O)CCCCCCC |