| SpectraBase Compound ID | AsMm260wVVI |
|---|---|
| InChI | InChI=1S/C10H9ClN2O/c1-7-2-3-8(6-9(7)11)13-10(14)4-5-12/h2-3,6H,4H2,1H3,(H,13,14) |
| InChIKey | JTBKZCLPLQHRBI-UHFFFAOYSA-N |
| Mol Weight | 208.65 g/mol |
| Molecular Formula | C10H9ClN2O |
| Exact Mass | 208.040341 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HIaTuFh3yCF |
|---|---|
| Name | N-(3-Chloro-4-methylphenyl)-2-cyanoacetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.040340617 u |
| Formula | C10H9ClN2O |
| InChI | InChI=1S/C10H9ClN2O/c1-7-2-3-8(6-9(7)11)13-10(14)4-5-12/h2-3,6H,4H2,1H3,(H,13,14) |
| InChIKey | JTBKZCLPLQHRBI-UHFFFAOYSA-N |
| Molecular Weight | 208.648 g/mol |
| SMILES | C1(Cl)=C(C=CC(=C1)NC(=O)CC#N)C |