SpectraBase Spectrum ID |
Ahs0rtmZnpS |
Name |
1,1-Dibutyl-3-(2,4-dichlorophenyl)urea |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
316.110918735 u |
Formula |
C15H22Cl2N2O |
InChI |
InChI=1S/C15H22Cl2N2O/c1-3-5-9-19(10-6-4-2)15(20)18-14-8-7-12(16)11-13(14)17/h7-8,11H,3-6,9-10H2,1-2H3,(H,18,20) |
InChIKey |
ZKUUQLDOBKHWMO-UHFFFAOYSA-N |
Molecular Weight |
317.260 g/mol |
SMILES |
N(C1=CC=C(C=C1Cl)Cl)C(N(CCCC)CCCC)=O |
Spectrum/Structure Validation Score (Raman) |
0.725405 |