![Ethyl 4-[2-(4-methylphenyl)ethenyl]benzoate](/api/spectrum/4GSBpdzUnzB/structure.png?h=300&w=458 "Ethyl 4-[2-(4-methylphenyl)ethenyl]benzoate")
| SpectraBase Compound ID | Cm57oCuxgBB |
|---|---|
| InChI | InChI=1S/C18H18O2/c1-3-20-18(19)17-12-10-16(11-13-17)9-8-15-6-4-14(2)5-7-15/h4-13H,3H2,1-2H3/b9-8+ |
| InChIKey | XCWJITVSBOIKHV-CMDGGOBGSA-N |
| Mol Weight | 266.34 g/mol |
| Molecular Formula | C18H18O2 |
| Exact Mass | 266.13068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4GSBpdzUnzB |
|---|---|
| Name | Ethyl 4-[2-(4-methylphenyl)ethenyl]benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 266.130679818 u |
| Formula | C18H18O2 |
| InChI | InChI=1S/C18H18O2/c1-3-20-18(19)17-12-10-16(11-13-17)9-8-15-6-4-14(2)5-7-15/h4-13H,3H2,1-2H3/b9-8+ |
| InChIKey | XCWJITVSBOIKHV-CMDGGOBGSA-N |
| Molecular Weight | 266.340 g/mol |
| SMILES | Cc1ccc(cc1)\C=C\c1ccc(cc1)C(=O)OCC |