| SpectraBase Compound ID | FnyzUTWftL6 |
|---|---|
| InChI | InChI=1S/C12H12N2O/c1-14(2)9-11(8-13)12(15)10-6-4-3-5-7-10/h3-7,9H,1-2H3/b11-9+ |
| InChIKey | ZHLDDWYMGDGHRL-PKNBQFBNSA-N |
| Mol Weight | 200.24 g/mol |
| Molecular Formula | C12H12N2O |
| Exact Mass | 200.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HO2SrVnF2fI |
|---|---|
| Name | (E)-2-Benzoyl-3-(dimethylamino)-2-propenenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.094963013 u |
| Formula | C12H12N2O |
| InChI | InChI=1S/C12H12N2O/c1-14(2)9-11(8-13)12(15)10-6-4-3-5-7-10/h3-7,9H,1-2H3/b11-9+ |
| InChIKey | ZHLDDWYMGDGHRL-PKNBQFBNSA-N |
| Molecular Weight | 200.241 g/mol |
| SMILES | C(\C(=C\N(C)C)C#N)(=O)C1=CC=CC=C1 |