| SpectraBase Compound ID | 2FGIRItaVT8 |
|---|---|
| InChI | InChI=1S/C17H13NO3/c1-2-11-20-15-9-5-14(6-10-15)17(19)21-16-7-3-13(12-18)4-8-16/h2-10H,1,11H2 |
| InChIKey | VMEDDXTXFHSFNR-UHFFFAOYSA-N |
| Mol Weight | 279.29 g/mol |
| Molecular Formula | C17H13NO3 |
| Exact Mass | 279.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EBeabDZ2EIi |
|---|---|
| Name | 4-Cyanophenyl 4-allyloxybenzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.089543280 u |
| Formula | C17H13NO3 |
| InChI | InChI=1S/C17H13NO3/c1-2-11-20-15-9-5-14(6-10-15)17(19)21-16-7-3-13(12-18)4-8-16/h2-10H,1,11H2 |
| InChIKey | VMEDDXTXFHSFNR-UHFFFAOYSA-N |
| Molecular Weight | 279.295 g/mol |
| SMILES | C(Oc1ccc(C#N)cc1)(c1ccc(cc1)OCC=C)=O |