| SpectraBase Compound ID | BXR8h6dvE0A |
|---|---|
| InChI | InChI=1S/C13H9ClN2O3/c14-10-2-1-3-11(8-10)15-13(17)9-4-6-12(7-5-9)16(18)19/h1-8H,(H,15,17) |
| InChIKey | KVVNRXNSICWUSG-UHFFFAOYSA-N |
| Mol Weight | 276.68 g/mol |
| Molecular Formula | C13H9ClN2O3 |
| Exact Mass | 276.03017 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C2WApZAkmnG |
|---|---|
| Name | Benzamide, N-(3-chlorophenyl)-4-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.030169855 u |
| Formula | C13H9ClN2O3 |
| InChI | InChI=1S/C13H9ClN2O3/c14-10-2-1-3-11(8-10)15-13(17)9-4-6-12(7-5-9)16(18)19/h1-8H,(H,15,17) |
| InChIKey | KVVNRXNSICWUSG-UHFFFAOYSA-N |
| SMILES | C1=C(C=CC(=C1)C(NC1=CC(=CC=C1)Cl)=O)N(=O)=O |