| SpectraBase Compound ID | 6itG9WIWq0X |
|---|---|
| InChI | InChI=1S/C16H16N2O2/c1-3-14(16(19)20-4-2)15(13(10-17)11-18)12-8-6-5-7-9-12/h3,5-9,13-15H,1,4H2,2H3 |
| InChIKey | VFHTWJJWNYICQW-UHFFFAOYSA-N |
| Mol Weight | 268.32 g/mol |
| Molecular Formula | C16H16N2O2 |
| Exact Mass | 268.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5a837KVQLiR |
|---|---|
| Name | Ethyl syn-4,4-dicyano-3-phenyl-2-vinylbutyrate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.121177761 u |
| Formula | C16H16N2O2 |
| InChI | InChI=1S/C16H16N2O2/c1-3-14(16(19)20-4-2)15(13(10-17)11-18)12-8-6-5-7-9-12/h3,5-9,13-15H,1,4H2,2H3 |
| InChIKey | VFHTWJJWNYICQW-UHFFFAOYSA-N |
| SMILES | C(C(C(C(C#N)C#N)C=1C=CC=CC1)C=C)(=O)OCC |