SpectraBase Spectrum ID |
9uJx1NH8LES |
Name |
Benzamide, 2-methyl-N-(2-butyl)-N-(2-ethylhexyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
303.256214686 u |
Formula |
C20H33NO |
InChI |
InChI=1S/C20H33NO/c1-6-9-13-18(8-3)15-21(17(5)7-2)20(22)19-14-11-10-12-16(19)4/h10-12,14,17-18H,6-9,13,15H2,1-5H3 |
InChIKey |
HZAQJJJNJISSME-UHFFFAOYSA-N |
SMILES |
C(N(CC(CCCC)CC)C(CC)C)(=O)C=1C(C)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946531 |