| SpectraBase Compound ID | AKZ5x1uURKb |
|---|---|
| InChI | InChI=1S/C10H12N2O3/c1-2-4-10(13)11-8-5-3-6-9(7-8)12(14)15/h3,5-7H,2,4H2,1H3,(H,11,13) |
| InChIKey | VXGYYWZDOBSZDA-UHFFFAOYSA-N |
| Mol Weight | 208.22 g/mol |
| Molecular Formula | C10H12N2O3 |
| Exact Mass | 208.084792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J5UV2VtfmR1 |
|---|---|
| Name | Butanamide, N-(3-nitrophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.084792251 u |
| Formula | C10H12N2O3 |
| InChI | InChI=1S/C10H12N2O3/c1-2-4-10(13)11-8-5-3-6-9(7-8)12(14)15/h3,5-7H,2,4H2,1H3,(H,11,13) |
| InChIKey | VXGYYWZDOBSZDA-UHFFFAOYSA-N |
| Molecular Weight | 208.217 g/mol |
| SMILES | CCCC(NC1=CC(=CC=C1)N(=O)=O)=O |