| SpectraBase Compound ID | 3Xvvi4EWeB0 |
|---|---|
| InChI | InChI=1S/C10H10O3/c1-7(11)6-10(13)8-4-2-3-5-9(8)12/h2-5,12H,6H2,1H3 |
| InChIKey | FAIACLOKYTYHSR-UHFFFAOYSA-N |
| Mol Weight | 178.19 g/mol |
| Molecular Formula | C10H10O3 |
| Exact Mass | 178.062994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BXu3bJSYhqL |
|---|---|
| Name | 1-(o-Hydroxyphenyl)-1,3-butanedione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.062994179 u |
| Formula | C10H10O3 |
| InChI | InChI=1S/C10H10O3/c1-7(11)6-10(13)8-4-2-3-5-9(8)12/h2-5,12H,6H2,1H3 |
| InChIKey | FAIACLOKYTYHSR-UHFFFAOYSA-N |
| Molecular Weight | 178.187 g/mol |
| SMILES | OC1=C(C(=O)CC(=O)C)C=CC=C1 |