| SpectraBase Compound ID | 2orYD8LX7rd |
|---|---|
| InChI | InChI=1S/C13H9BrN2O3/c14-10-3-1-9(2-4-10)13(17)15-11-5-7-12(8-6-11)16(18)19/h1-8H,(H,15,17) |
| InChIKey | CJNOQHFTPGQBMZ-UHFFFAOYSA-N |
| Mol Weight | 321.13 g/mol |
| Molecular Formula | C13H9BrN2O3 |
| Exact Mass | 319.979655 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AQ9NzqTGapE |
|---|---|
| Name | Benzamide, 4-bromo-N-(4-nitrophenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.979655155 u |
| Formula | C13H9BrN2O3 |
| InChI | InChI=1S/C13H9BrN2O3/c14-10-3-1-9(2-4-10)13(17)15-11-5-7-12(8-6-11)16(18)19/h1-8H,(H,15,17) |
| InChIKey | CJNOQHFTPGQBMZ-UHFFFAOYSA-N |
| Molecular Weight | 321.130 g/mol |
| SMILES | C(NC1=CC=C(C=C1)N(=O)=O)(=O)C1=CC=C(C=C1)Br |