| SpectraBase Compound ID | 5MlqfyqJT1n |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-8(2)11(13)12(14)9-4-6-10(15-3)7-5-9/h4-8,12,14H,1-3H3 |
| InChIKey | XAMUGYICIMCNHN-UHFFFAOYSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FG3Kqq9WVWM |
|---|---|
| Name | 1-Hydroxy-1-(4-methoxyphenyl)-3-methylbutan-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.109944372 u |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c1-8(2)11(13)12(14)9-4-6-10(15-3)7-5-9/h4-8,12,14H,1-3H3 |
| InChIKey | XAMUGYICIMCNHN-UHFFFAOYSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C(C(C=1C=CC(=CC1)OC)O)(=O)C(C)C |