| SpectraBase Compound ID | 9IfWVMxPgGp |
|---|---|
| InChI | InChI=1S/C11H12N2O2/c1-2-15-10-5-3-9(4-6-10)11(14)13-8-7-12/h3-6H,2,8H2,1H3,(H,13,14) |
| InChIKey | FIGRBIMULGRYQE-UHFFFAOYSA-N |
| Mol Weight | 204.23 g/mol |
| Molecular Formula | C11H12N2O2 |
| Exact Mass | 204.089878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G6vPzy0tkE8 |
|---|---|
| Name | N-(Cyanomethyl)-4-ethoxybenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.089877632 u |
| Formula | C11H12N2O2 |
| InChI | InChI=1S/C11H12N2O2/c1-2-15-10-5-3-9(4-6-10)11(14)13-8-7-12/h3-6H,2,8H2,1H3,(H,13,14) |
| InChIKey | FIGRBIMULGRYQE-UHFFFAOYSA-N |
| Molecular Weight | 204.229 g/mol |
| SMILES | N(C(C1=CC=C(OCC)C=C1)=O)CC#N |