| SpectraBase Compound ID | Dmvi8KuEc2v |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-3-14-12(13)9-8-11-7-5-4-6-10(11)2/h4-9H,3H2,1-2H3/b9-8+ |
| InChIKey | FVVNCRMEGJFCPL-CMDGGOBGSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 48rB0jkASV1 |
|---|---|
| Name | (E)-3-(2-Methylphenyl)-2-propenoic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.099379689 u |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-3-14-12(13)9-8-11-7-5-4-6-10(11)2/h4-9H,3H2,1-2H3/b9-8+ |
| InChIKey | FVVNCRMEGJFCPL-CMDGGOBGSA-N |
| Molecular Weight | 190.242 g/mol |
| SMILES | C(\C=C\C=1C(C)=CC=CC1)(=O)OCC |