| SpectraBase Compound ID | 4ut6gznZ5vs |
|---|---|
| InChI | InChI=1S/C16H12O5/c17-13(10-6-2-1-3-7-10)14(18)11-8-4-5-9-12(11)15(19)16(20)21/h1-9,13,17H,(H,20,21) |
| InChIKey | YRQOPFGYCAMUHM-UHFFFAOYSA-N |
| Mol Weight | 284.27 g/mol |
| Molecular Formula | C16H12O5 |
| Exact Mass | 284.068473 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A0J8KesPQIT |
|---|---|
| Name | 2-(2-Hydroxy-2-phenylacetyl)phenylglyoxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.068473481 u |
| Formula | C16H12O5 |
| InChI | InChI=1S/C16H12O5/c17-13(10-6-2-1-3-7-10)14(18)11-8-4-5-9-12(11)15(19)16(20)21/h1-9,13,17H,(H,20,21) |
| InChIKey | YRQOPFGYCAMUHM-UHFFFAOYSA-N |
| SMILES | C1(=C(C=CC=C1)C(=O)C(O)=O)C(=O)C(O)C1=CC=CC=C1 |