| SpectraBase Compound ID | AlgV51n0sTV |
|---|---|
| InChI | InChI=1S/C12H12N2O3/c1-16-10-4-3-8(6-11(10)17-2)5-9(7-13)12(14)15/h3-6H,1-2H3,(H2,14,15) |
| InChIKey | UHGNGGISEFEZHE-UHFFFAOYSA-N |
| Mol Weight | 232.24 g/mol |
| Molecular Formula | C12H12N2O3 |
| Exact Mass | 232.084792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I5R0uDxbrHK |
|---|---|
| Name | alpha-Cyano-3,4-dimethoxycinnamamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.084792251 u |
| Formula | C12H12N2O3 |
| InChI | InChI=1S/C12H12N2O3/c1-16-10-4-3-8(6-11(10)17-2)5-9(7-13)12(14)15/h3-6H,1-2H3,(H2,14,15) |
| InChIKey | UHGNGGISEFEZHE-UHFFFAOYSA-N |
| Molecular Weight | 232.239 g/mol |
| SMILES | NC(C(=CC1=CC=C(C(=C1)OC)OC)C#N)=O |