![4H-Pyran-2-carboxylic acid, 6-[p-chlorophenyl]-4-oxo-, ethyl ester](/api/spectrum/AbsHutCvq70/structure.png?h=300&w=458 "4H-Pyran-2-carboxylic acid, 6-[p-chlorophenyl]-4-oxo-, ethyl ester")
| SpectraBase Compound ID | 98a78Uz8b0f |
|---|---|
| InChI | InChI=1S/C14H11ClO4/c1-2-18-14(17)13-8-11(16)7-12(19-13)9-3-5-10(15)6-4-9/h3-8H,2H2,1H3 |
| InChIKey | UCJXTIILKCOLGP-UHFFFAOYSA-N |
| Mol Weight | 278.69 g/mol |
| Molecular Formula | C14H11ClO4 |
| Exact Mass | 278.034587 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AbsHutCvq70 |
|---|---|
| Name | 4H-Pyran-2-carboxylic acid, 6-[p-chlorophenyl]-4-oxo-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.034586530 u |
| Formula | C14H11ClO4 |
| InChI | InChI=1S/C14H11ClO4/c1-2-18-14(17)13-8-11(16)7-12(19-13)9-3-5-10(15)6-4-9/h3-8H,2H2,1H3 |
| InChIKey | UCJXTIILKCOLGP-UHFFFAOYSA-N |
| SMILES | C1(=CC=C(C=C1)Cl)C1=CC(C=C(O1)C(OCC)=O)=O |