| SpectraBase Compound ID | 6NSU6uwiKdh |
|---|---|
| InChI | InChI=1S/C12H12O2/c1-3-10-6-4-5-7-11(10)8-9-12(13)14-2/h3-9H,1H2,2H3/b9-8+ |
| InChIKey | XOOIMPHHQGUHDN-CMDGGOBGSA-N |
| Mol Weight | 188.23 g/mol |
| Molecular Formula | C12H12O2 |
| Exact Mass | 188.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AgjOgLX5u4c |
|---|---|
| Name | Methyl 3-(2'-ethenylphenyl)propenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.083729624 u |
| Formula | C12H12O2 |
| InChI | InChI=1S/C12H12O2/c1-3-10-6-4-5-7-11(10)8-9-12(13)14-2/h3-9H,1H2,2H3/b9-8+ |
| InChIKey | XOOIMPHHQGUHDN-CMDGGOBGSA-N |
| Molecular Weight | 188.226 g/mol |
| SMILES | C(\C=C\C=1C(C=C)=CC=CC1)(=O)OC |