| SpectraBase Compound ID | okybHsqdUe |
|---|---|
| InChI | InChI=1S/C17H16O2/c1-13-8-6-7-11-15(13)16(17(18)19-2)12-14-9-4-3-5-10-14/h3-12H,1-2H3/b16-12+ |
| InChIKey | XFVLOHKGYZPHLG-FOWTUZBSSA-N |
| Mol Weight | 252.31 g/mol |
| Molecular Formula | C17H16O2 |
| Exact Mass | 252.11503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CWRbFxkZ4hY |
|---|---|
| Name | (E)-Methyl 3-phenyl-2-o-tolylacrylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.115029753 u |
| Formula | C17H16O2 |
| InChI | InChI=1S/C17H16O2/c1-13-8-6-7-11-15(13)16(17(18)19-2)12-14-9-4-3-5-10-14/h3-12H,1-2H3/b16-12+ |
| InChIKey | XFVLOHKGYZPHLG-FOWTUZBSSA-N |
| Molecular Weight | 252.313 g/mol |
| SMILES | C(\C(=C\C=1C=CC=CC1)C=1C(=CC=CC1)C)(=O)OC |