SpectraBase Spectrum ID |
F2J9BKo8bHn |
Name |
Urea, N,N-dimethyl-N'-benzyl-N'-pentyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
248.188863400 u |
Formula |
C15H24N2O |
InChI |
InChI=1S/C15H24N2O/c1-4-5-9-12-17(15(18)16(2)3)13-14-10-7-6-8-11-14/h6-8,10-11H,4-5,9,12-13H2,1-3H3 |
InChIKey |
QTUNLZFSZKCLOM-UHFFFAOYSA-N |
Molecular Weight |
248.370 g/mol |
SMILES |
C(N(CCCCC)CC1=CC=CC=C1)(=O)N(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839568 |