| SpectraBase Compound ID | ENqqvZFyF4E |
|---|---|
| InChI | InChI=1S/C16H11BrN2O2/c17-10-5-7-11(8-6-10)19-16(21)15(20)13-9-18-14-4-2-1-3-12(13)14/h1-9,18H,(H,19,21) |
| InChIKey | JVCZECLEXIQMDE-UHFFFAOYSA-N |
| Mol Weight | 343.18 g/mol |
| Molecular Formula | C16H11BrN2O2 |
| Exact Mass | 342.000391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ADt3aifSND |
|---|---|
| Name | N-(4-Bromo-phenyl)-2-(1H-indol-3-yl)-2-oxo-acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 342.000390600 u |
| Formula | C16H11BrN2O2 |
| InChI | InChI=1S/C16H11BrN2O2/c17-10-5-7-11(8-6-10)19-16(21)15(20)13-9-18-14-4-2-1-3-12(13)14/h1-9,18H,(H,19,21) |
| InChIKey | JVCZECLEXIQMDE-UHFFFAOYSA-N |
| Molecular Weight | 343.180 g/mol |
| SMILES | C1(C(C(NC2=CC=C(C=C2)Br)=O)=O)=CNC=2C1=CC=CC2 |