| SpectraBase Compound ID | 8QYwzFb18uP |
|---|---|
| InChI | InChI=1S/C17H11BrClNO2/c1-10(22)20-16-7-4-12(18)8-14(16)15(9-21)17(20)11-2-5-13(19)6-3-11/h2-9H,1H3 |
| InChIKey | RTFCNYAYQMYHFV-UHFFFAOYSA-N |
| Mol Weight | 376.64 g/mol |
| Molecular Formula | C17H11BrClNO2 |
| Exact Mass | 374.966169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I8x30eXohgB |
|---|---|
| Name | 5-Bromo-2-(4-chlorophenyl)-1H-indole-3-carbaldehyde, N-acetyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 374.966169296 u |
| Formula | C17H11BrClNO2 |
| InChI | InChI=1S/C17H11BrClNO2/c1-10(22)20-16-7-4-12(18)8-14(16)15(9-21)17(20)11-2-5-13(19)6-3-11/h2-9H,1H3 |
| InChIKey | RTFCNYAYQMYHFV-UHFFFAOYSA-N |
| Molecular Weight | 376.637 g/mol |
| SMILES | C=1(N(C2=C(C1C=O)C=C(C=C2)Br)C(=O)C)C1=CC=C(C=C1)Cl |