| SpectraBase Compound ID | 9YDmyhbiZEk |
|---|---|
| InChI | InChI=1S/C14H12O4/c1-10(15)17-9-14(16)18-13-8-4-6-11-5-2-3-7-12(11)13/h2-8H,9H2,1H3 |
| InChIKey | NXKZMCDDKZZDHM-UHFFFAOYSA-N |
| Mol Weight | 244.25 g/mol |
| Molecular Formula | C14H12O4 |
| Exact Mass | 244.073559 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A4e4pYNmfyv |
|---|---|
| Name | Acetoxyacetic acid, 1-naphthyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.073558862 u |
| Formula | C14H12O4 |
| InChI | InChI=1S/C14H12O4/c1-10(15)17-9-14(16)18-13-8-4-6-11-5-2-3-7-12(11)13/h2-8H,9H2,1H3 |
| InChIKey | NXKZMCDDKZZDHM-UHFFFAOYSA-N |
| Molecular Weight | 244.246 g/mol |
| SMILES | CC(=O)OCC(OC=1C2=CC=CC=C2C=CC1)=O |