| SpectraBase Spectrum ID |
KPNv8KzGxuJ |
| Name |
1,1-Diisobutyl-3-(6-ethyl-o-tolyl)urea |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.235813593 u |
| Formula |
C18H30N2O |
| InChI |
InChI=1S/C18H30N2O/c1-7-16-10-8-9-15(6)17(16)19-18(21)20(11-13(2)3)12-14(4)5/h8-10,13-14H,7,11-12H2,1-6H3,(H,19,21) |
| InChIKey |
ZKCHDRSYNJKSFW-UHFFFAOYSA-N |
| Molecular Weight |
290.451 g/mol |
| SMILES |
N(C1=C(C=CC=C1CC)C)C(N(CC(C)C)CC(C)C)=O |
| Spectrum/Structure Validation Score (Raman) |
0.97638 |
