| SpectraBase Compound ID | AmADVRR7lNh |
|---|---|
| InChI | InChI=1S/C16H10N2/c17-11-14-8-6-13(7-9-14)10-16(12-18)15-4-2-1-3-5-15/h1-10H/b16-10+ |
| InChIKey | LMSMJIGIXAYRRL-MHWRWJLKSA-N |
| Mol Weight | 230.27 g/mol |
| Molecular Formula | C16H10N2 |
| Exact Mass | 230.084398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7rQbTntSWyz |
|---|---|
| Name | Benzonitrile, 4-(2-cyano-2-phenylethenyl) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.084398330 u |
| Formula | C16H10N2 |
| InChI | InChI=1S/C16H10N2/c17-11-14-8-6-13(7-9-14)10-16(12-18)15-4-2-1-3-5-15/h1-10H/b16-10+ |
| InChIKey | LMSMJIGIXAYRRL-MHWRWJLKSA-N |
| Molecular Weight | 230.270 g/mol |
| SMILES | C1=CC(=CC=C1\C=C\(C1=CC=CC=C1)C#N)C#N |