SpectraBase Spectrum ID |
6x1GGNXtSU1 |
Name |
Urea, (2-isopropyl-4-pentenoyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
184.121177761 u |
Formula |
C9H16N2O2 |
InChI |
InChI=1S/C9H16N2O2/c1-4-5-7(6(2)3)8(12)11-9(10)13/h4,6-7H,1,5H2,2-3H3,(H3,10,11,12,13) |
InChIKey |
KSUUMAWCGDNLFK-UHFFFAOYSA-N |
Molecular Weight |
184.239 g/mol |
SMILES |
C(N)(NC(C(C(C)C)CC=C)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.808716 |