| SpectraBase Compound ID | 9n9P49xt8CY |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-4-6-9-7-5-8-10(14-2)11(9)12(13)15-3/h4-5,7-8H,1,6H2,2-3H3 |
| InChIKey | SMYVIKSELAZARU-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 | 2bPklfIYyCZ |
|---|---|
| Name | 2-Allyl-6-methoxy-benzoic acid methyl 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/c1-4-6-9-7-5-8-10(14-2)11(9)12(13)15-3/h4-5,7-8H,1,6H2,2-3H3 |
| InChIKey | SMYVIKSELAZARU-UHFFFAOYSA-N |
| Molecular Weight | 206.241 g/mol |
| SMILES | C(C=1C(=CC=CC1OC)CC=C)(=O)OC |