SpectraBase Spectrum ID |
3tWElX5mKgB |
Name |
Benzamide, 4-bromo-N-(2-allylamino-2-oxo-1-benzylidenethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
384.047340793 u |
Formula |
C19H17BrN2O2 |
InChI |
InChI=1S/C19H17BrN2O2/c1-2-12-21-19(24)17(13-14-6-4-3-5-7-14)22-18(23)15-8-10-16(20)11-9-15/h2-11,13H,1,12H2,(H,21,24)(H,22,23)/b17-13- |
InChIKey |
YPZWEKVYJWDTLE-LGMDPLHJSA-N |
Molecular Weight |
385.261 g/mol |
SMILES |
C1=C(C=CC(=C1)Br)C(N\C(=C/C1=CC=CC=C1)C(NCC=C)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951611 |