| SpectraBase Compound ID | Fb5i5y3giOO |
|---|---|
| InChI | InChI=1S/C12H10O3/c13-8-11-6-10(14)7-12(15-11)9-4-2-1-3-5-9/h1-7,13H,8H2 |
| InChIKey | AECCTQOQPCLSRL-UHFFFAOYSA-N |
| Mol Weight | 202.21 g/mol |
| Molecular Formula | C12H10O3 |
| Exact Mass | 202.062994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JdDa1ObqGh7 |
|---|---|
| Name | 2-Hydroxymethyl-6-phenyl-4H-pyran-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.062994179 u |
| Formula | C12H10O3 |
| InChI | InChI=1S/C12H10O3/c13-8-11-6-10(14)7-12(15-11)9-4-2-1-3-5-9/h1-7,13H,8H2 |
| InChIKey | AECCTQOQPCLSRL-UHFFFAOYSA-N |
| Molecular Weight | 202.209 g/mol |
| SMILES | C1(=CC(=O)C=C(O1)CO)C=1C=CC=CC1 |