SpectraBase Spectrum ID |
DdmXGAXBZKh |
Name |
Butyramide, 2-phenyl-N-(2-butyl)-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.240564621 u |
Formula |
C19H31NO |
InChI |
InChI=1S/C19H31NO/c1-6-16(5)20(14-13-15(3)4)19(21)18(7-2)17-11-9-8-10-12-17/h8-12,15-16,18H,6-7,13-14H2,1-5H3 |
InChIKey |
LIPUXXPIZCDCFF-UHFFFAOYSA-N |
Molecular Weight |
289.463 g/mol |
SMILES |
C(N(CCC(C)C)C(CC)C)(=O)C(CC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900764 |