| SpectraBase Compound ID | 13wiogcYW2n |
|---|---|
| InChI | InChI=1S/C12H14O5/c1-2-16-7-8-17-12(15)10-6-4-3-5-9(10)11(13)14/h3-6H,2,7-8H2,1H3,(H,13,14) |
| InChIKey | FCJKZKYOELZWNI-UHFFFAOYSA-N |
| Mol Weight | 238.24 g/mol |
| Molecular Formula | C12H14O5 |
| Exact Mass | 238.084124 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9lKQKGFnc6e |
|---|---|
| Name | 2-((2-Ethoxyethoxy)carbonyl)benzoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.084123546 u |
| Formula | C12H14O5 |
| InChI | InChI=1S/C12H14O5/c1-2-16-7-8-17-12(15)10-6-4-3-5-9(10)11(13)14/h3-6H,2,7-8H2,1H3,(H,13,14) |
| InChIKey | FCJKZKYOELZWNI-UHFFFAOYSA-N |
| Molecular Weight | 238.239 g/mol |
| SMILES | C1=CC=C(C(=C1)C(=O)OCCOCC)C(=O)O |