| SpectraBase Compound ID | 7LUswdIJxAB |
|---|---|
| InChI | InChI=1S/C14H18O2/c1-2-3-9-13(15)14(16)11-10-12-7-5-4-6-8-12/h4-8,10-11,13,15H,2-3,9H2,1H3/b11-10+ |
| InChIKey | XDRLRDSPPYEERE-ZHACJKMWSA-N |
| Mol Weight | 218.3 g/mol |
| Molecular Formula | C14H18O2 |
| Exact Mass | 218.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LjotWcclCMO |
|---|---|
| Name | 4-Hydroxy-1-phenylocten-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.130679818 u |
| Formula | C14H18O2 |
| InChI | InChI=1S/C14H18O2/c1-2-3-9-13(15)14(16)11-10-12-7-5-4-6-8-12/h4-8,10-11,13,15H,2-3,9H2,1H3/b11-10+ |
| InChIKey | XDRLRDSPPYEERE-ZHACJKMWSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | C(\C=C\C1=CC=CC=C1)(=O)C(O)CCCC |