| SpectraBase Compound ID | DiRSrf6YxNz |
|---|---|
| InChI | InChI=1S/C15H14O4/c1-19-13-9-7-12(8-10-13)15(18,14(16)17)11-5-3-2-4-6-11/h2-10,18H,1H3,(H,16,17) |
| InChIKey | KWRLXQHDQNHPLW-UHFFFAOYSA-N |
| Mol Weight | 258.27 g/mol |
| Molecular Formula | C15H14O4 |
| Exact Mass | 258.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fkwl2lbYq97 |
|---|---|
| Name | Benzeneethanoic acid, .alpha.-(4-methoxyphenyl)-.alpha.-hydroxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.089208927 u |
| Formula | C15H14O4 |
| InChI | InChI=1S/C15H14O4/c1-19-13-9-7-12(8-10-13)15(18,14(16)17)11-5-3-2-4-6-11/h2-10,18H,1H3,(H,16,17) |
| InChIKey | KWRLXQHDQNHPLW-UHFFFAOYSA-N |
| Molecular Weight | 258.273 g/mol |
| SMILES | C1(=CC=CC=C1)C(C1=CC=C(C=C1)OC)(O)C(O)=O |