| SpectraBase Spectrum ID |
EC2LCYAvya2 |
| Name |
beta-Alanine, N-(3,4-dichlorophenyl)-3-oxo-, 2-[(E)-(4-bromophenyl)methylidene]hydrazide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
426.948995036 u |
| Formula |
C16H12BrCl2N3O2 |
| InChI |
InChI=1S/C16H12BrCl2N3O2/c17-11-3-1-10(2-4-11)9-20-22-16(24)8-15(23)21-12-5-6-13(18)14(19)7-12/h1-7,9H,8H2,(H,21,23)(H,22,24)/b20-9+ |
| InChIKey |
ZDUALHAWTYCGNX-AWQFTUOYSA-N |
| Molecular Weight |
429.101 g/mol |
| SMILES |
N(\N=C\C=1C=CC(=CC1)Br)C(CC(NC1=CC(Cl)=C(C=C1)Cl)=O)=O |