| SpectraBase Compound ID | 6OV8bIahC2f |
|---|---|
| InChI | InChI=1S/C11H12O2/c1-8(2)7-11(13)9-3-5-10(12)6-4-9/h3-7,12H,1-2H3 |
| InChIKey | DCXZYKGYIWHWMI-UHFFFAOYSA-N |
| Mol Weight | 176.21 g/mol |
| Molecular Formula | C11H12O2 |
| Exact Mass | 176.08373 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 | 7QHMPgO4MYO |
|---|---|
| Name | 1-(4-Hydroxyphenyl)-3-methyl-2-buten-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.083729624 u |
| Formula | C11H12O2 |
| InChI | InChI=1S/C11H12O2/c1-8(2)7-11(13)9-3-5-10(12)6-4-9/h3-7,12H,1-2H3 |
| InChIKey | DCXZYKGYIWHWMI-UHFFFAOYSA-N |
| Molecular Weight | 176.215 g/mol |
| SMILES | C(C(C=1C=CC(=CC1)O)=O)=C(C)C |