SpectraBase Spectrum ID |
gaVgCFgztM |
Name |
N-(2,5-Dichlorophenyl)-2-methylpropanamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.021769377 u |
Formula |
C10H11Cl2NO |
InChI |
InChI=1S/C10H11Cl2NO/c1-6(2)10(14)13-9-5-7(11)3-4-8(9)12/h3-6H,1-2H3,(H,13,14) |
InChIKey |
VOCOLIKSFJGAIB-UHFFFAOYSA-N |
Molecular Weight |
232.110 g/mol |
SMILES |
C(NC1=CC(Cl)=CC=C1Cl)(=O)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933722 |