SpectraBase Spectrum ID |
3JzPG1ZapEI |
Name |
Benzamide, 2,4-dimethyl-N-(2-ethylhexyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
261.209264492 u |
Formula |
C17H27NO |
InChI |
InChI=1S/C17H27NO/c1-5-7-8-15(6-2)12-18-17(19)16-10-9-13(3)11-14(16)4/h9-11,15H,5-8,12H2,1-4H3,(H,18,19) |
InChIKey |
QZSFSJGRIBBHNY-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
C(CNC(=O)C1=C(C)C=C(C)C=C1)(CCCC)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972205 |