| SpectraBase Compound ID | 6cN5BLdYjyR |
|---|---|
| InChI | InChI=1S/C11H12O2/c1-3-4-10-7-9(8(2)12)5-6-11(10)13/h3,5-7,13H,1,4H2,2H3 |
| InChIKey | XVTCWUFLNLZPEJ-UHFFFAOYSA-N |
| Mol Weight | 176.21 g/mol |
| Molecular Formula | C11H12O2 |
| Exact Mass | 176.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3qumfXYI0K9 |
|---|---|
| Name | Acetophenone, 3'-allyl-4'-hydroxy- |
| 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/c1-3-4-10-7-9(8(2)12)5-6-11(10)13/h3,5-7,13H,1,4H2,2H3 |
| InChIKey | XVTCWUFLNLZPEJ-UHFFFAOYSA-N |
| Molecular Weight | 176.215 g/mol |
| SMILES | C1=CC(=CC(=C1O)CC=C)C(=O)C |