| SpectraBase Compound ID | 5TqU4Z6Lsvj |
|---|---|
| InChI | InChI=1S/C13H14O4/c14-10-6-2-1-5-9(10)13(16)17-12-8-4-3-7-11(12)15/h3-4,7-9,15H,1-2,5-6H2 |
| InChIKey | DRTLAATXOYLVKS-UHFFFAOYSA-N |
| Mol Weight | 234.25 g/mol |
| Molecular Formula | C13H14O4 |
| Exact Mass | 234.089209 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lgGE8kkqtv |
|---|---|
| Name | 2-Oxocyclohexanecarboxylic acid, o-hydroxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.089208927 u |
| Formula | C13H14O4 |
| InChI | InChI=1S/C13H14O4/c14-10-6-2-1-5-9(10)13(16)17-12-8-4-3-7-11(12)15/h3-4,7-9,15H,1-2,5-6H2 |
| InChIKey | DRTLAATXOYLVKS-UHFFFAOYSA-N |
| Molecular Weight | 234.251 g/mol |
| SMILES | OC=1C=CC=CC1OC(C1CCCCC1=O)=O |