| SpectraBase Compound ID | 9UObZyOvh46 |
|---|---|
| InChI | InChI=1S/C14H20O3/c1-2-3-4-5-6-7-13(16)12-10-11(15)8-9-14(12)17/h8-10,15,17H,2-7H2,1H3 |
| InChIKey | UVAFQENBAUNGJG-UHFFFAOYSA-N |
| Mol Weight | 236.31 g/mol |
| Molecular Formula | C14H20O3 |
| Exact Mass | 236.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AH7CjLQNevF |
|---|---|
| Name | 1-Octanone, 1-(2,5-dihydroxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.141244501 u |
| Formula | C14H20O3 |
| InChI | InChI=1S/C14H20O3/c1-2-3-4-5-6-7-13(16)12-10-11(15)8-9-14(12)17/h8-10,15,17H,2-7H2,1H3 |
| InChIKey | UVAFQENBAUNGJG-UHFFFAOYSA-N |
| Molecular Weight | 236.311 g/mol |
| SMILES | CCCCCCCC(=O)C1=CC(O)=CC=C1O |