![acetamide, 2-cyano-N-[2-(1-methylethyl)phenyl]-](/api/spectrum/5MMkOSaZvAO/structure.png?h=300&w=458 "acetamide, 2-cyano-N-[2-(1-methylethyl)phenyl]-")
| SpectraBase Compound ID | BLmI3xzURwJ |
|---|---|
| InChI | InChI=1S/C12H14N2O/c1-9(2)10-5-3-4-6-11(10)14-12(15)7-8-13/h3-6,9H,7H2,1-2H3,(H,14,15) |
| InChIKey | OZKZUSINEUZVFR-UHFFFAOYSA-N |
| Mol Weight | 202.26 g/mol |
| Molecular Formula | C12H14N2O |
| Exact Mass | 202.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5MMkOSaZvAO |
|---|---|
| Name | Acetamide, 2-cyano-N-[2-(1-methylethyl)phenyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.110613078 u |
| Formula | C12H14N2O |
| InChI | InChI=1S/C12H14N2O/c1-9(2)10-5-3-4-6-11(10)14-12(15)7-8-13/h3-6,9H,7H2,1-2H3,(H,14,15) |
| InChIKey | OZKZUSINEUZVFR-UHFFFAOYSA-N |
| Molecular Weight | 202.257 g/mol |
| SMILES | N(C1=C(C(C)C)C=CC=C1)C(CC#N)=O |