| SpectraBase Compound ID | HVYQyA9RQPg |
|---|---|
| InChI | InChI=1S/C17H13NO3/c1-21-16-8-4-13(5-9-16)17(20)14(11-18)10-12-2-6-15(19)7-3-12/h2-10,19H,1H3/b14-10+ |
| InChIKey | DJZRNWUYJPBYEA-GXDHUFHOSA-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 | E5JZr58bEZr |
|---|---|
| Name | 3-(4-Hydroxyphenyl)-2-(4-methoxybenzoyl)acrylonitrile |
| 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/c1-21-16-8-4-13(5-9-16)17(20)14(11-18)10-12-2-6-15(19)7-3-12/h2-10,19H,1H3/b14-10+ |
| InChIKey | DJZRNWUYJPBYEA-GXDHUFHOSA-N |
| Molecular Weight | 279.295 g/mol |
| SMILES | C(\C(=C\C1=CC=C(O)C=C1)C#N)(C1=CC=C(OC)C=C1)=O |