| SpectraBase Compound ID | 5XBAvhXBhQ2 |
|---|---|
| InChI | InChI=1S/C16H13NO2/c1-2-19-16(18)15(11-17)10-12-7-8-13-5-3-4-6-14(13)9-12/h3-10H,2H2,1H3/b15-10+ |
| InChIKey | OCPOYALXTVXRED-XNTDXEJSSA-N |
| Mol Weight | 251.28 g/mol |
| Molecular Formula | C16H13NO2 |
| Exact Mass | 251.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BLwofN79wfG |
|---|---|
| Name | Ethyl 2-cyano-trans-3-(2-naphthyl)acrylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.094628661 u |
| Formula | C16H13NO2 |
| InChI | InChI=1S/C16H13NO2/c1-2-19-16(18)15(11-17)10-12-7-8-13-5-3-4-6-14(13)9-12/h3-10H,2H2,1H3/b15-10+ |
| InChIKey | OCPOYALXTVXRED-XNTDXEJSSA-N |
| Molecular Weight | 251.285 g/mol |
| SMILES | C1=2C(=CC(=CC2)\C=C\(C(OCC)=O)C#N)C=CC=C1 |