| SpectraBase Compound ID | EzM8xBEdFvQ |
|---|---|
| InChI | InChI=1S/C11H14O3/c1-14-11(13)4-2-3-9-5-7-10(12)8-6-9/h5-8,12H,2-4H2,1H3 |
| InChIKey | UZHISWLCHOMTIO-UHFFFAOYSA-N |
| Mol Weight | 194.23 g/mol |
| Molecular Formula | C11H14O3 |
| Exact Mass | 194.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2SZj91Saedm |
|---|---|
| Name | Benzenebutanoic acid, 4-hydroxy-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.094294308 u |
| Formula | C11H14O3 |
| InChI | InChI=1S/C11H14O3/c1-14-11(13)4-2-3-9-5-7-10(12)8-6-9/h5-8,12H,2-4H2,1H3 |
| InChIKey | UZHISWLCHOMTIO-UHFFFAOYSA-N |
| Molecular Weight | 194.230 g/mol |
| SMILES | C(CCC(OC)=O)C1=CC=C(C=C1)O |