| SpectraBase Compound ID | Ku0kNMb4EOB |
|---|---|
| InChI | InChI=1S/C13H18N2O3/c1-4-10(2)14(3)13(16)9-11-5-7-12(8-6-11)15(17)18/h5-8,10H,4,9H2,1-3H3 |
| InChIKey | YYOKJQSGPPGJRE-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C13H18N2O3 |
| Exact Mass | 250.131742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JSSCWHfXhsZ |
|---|---|
| Name | Acetamide, 2-(4-nitrophenyl)-N-(2-butyl)-N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.131742445 u |
| Formula | C13H18N2O3 |
| InChI | InChI=1S/C13H18N2O3/c1-4-10(2)14(3)13(16)9-11-5-7-12(8-6-11)15(17)18/h5-8,10H,4,9H2,1-3H3 |
| InChIKey | YYOKJQSGPPGJRE-UHFFFAOYSA-N |
| Molecular Weight | 250.298 g/mol |
| SMILES | C1=C(C=CC(=C1)N(=O)=O)CC(N(C)C(CC)C)=O |