| SpectraBase Compound ID | D21N1EoRM1 |
|---|---|
| InChI | InChI=1S/C9H9ClN2O3/c1-6(10)9(13)11-7-3-2-4-8(5-7)12(14)15/h2-6H,1H3,(H,11,13) |
| InChIKey | DKFBWJTZPPJWFC-UHFFFAOYSA-N |
| Mol Weight | 228.63 g/mol |
| Molecular Formula | C9H9ClN2O3 |
| Exact Mass | 228.03017 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2QGgajLpAjo |
|---|---|
| Name | Propanamide, N-(3-nitrophenyl)-2-chloro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 228.030169855 u |
| Formula | C9H9ClN2O3 |
| InChI | InChI=1S/C9H9ClN2O3/c1-6(10)9(13)11-7-3-2-4-8(5-7)12(14)15/h2-6H,1H3,(H,11,13) |
| InChIKey | DKFBWJTZPPJWFC-UHFFFAOYSA-N |
| SMILES | CC(C(NC=1C=C(C=CC1)N(=O)=O)=O)Cl |