| SpectraBase Compound ID | 6JcWNlnmLdL |
|---|---|
| InChI | InChI=1S/C13H16O/c1-10(2)11(3)9-13(14)12-7-5-4-6-8-12/h4-8H,9H2,1-3H3 |
| InChIKey | OCHGQWPUPJCFGF-UHFFFAOYSA-N |
| Mol Weight | 188.27 g/mol |
| Molecular Formula | C13H16O |
| Exact Mass | 188.120115 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 | 4LoJQ0tBAXA |
|---|---|
| Name | 2,3-Dimethylbut-2-enyl phenyl ketone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.120115134 u |
| Formula | C13H16O |
| InChI | InChI=1S/C13H16O/c1-10(2)11(3)9-13(14)12-7-5-4-6-8-12/h4-8H,9H2,1-3H3 |
| InChIKey | OCHGQWPUPJCFGF-UHFFFAOYSA-N |
| Molecular Weight | 188.270 g/mol |
| SMILES | C(CC(=O)C=1C=CC=CC1)(=C(C)C)C |