| SpectraBase Compound ID | 5Df5ysCohTl |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-9(2)8-12(13)15-11-6-4-10(14-3)5-7-11/h4-8H,1-3H3 |
| InChIKey | LYIMDMMPUGFSEH-UHFFFAOYSA-N |
| Mol Weight | 206.24 g/mol |
| Molecular Formula | C12H14O3 |
| Exact Mass | 206.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K79fARHeVvD |
|---|---|
| Name | 3-Methylbut-2-enoic acid, 4-methoxyphenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.094294308 u |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-9(2)8-12(13)15-11-6-4-10(14-3)5-7-11/h4-8H,1-3H3 |
| InChIKey | LYIMDMMPUGFSEH-UHFFFAOYSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | CC(C)=CC(OC1=CC=C(OC)C=C1)=O |