SpectraBase Spectrum ID |
Bjn1qDBj42w |
Name |
Benzamide, 4-(tert-butyl)-N-(2-pentyl)-N-propyl- |
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/c1-7-9-15(3)20(14-8-2)18(21)16-10-12-17(13-11-16)19(4,5)6/h10-13,15H,7-9,14H2,1-6H3 |
InChIKey |
MJKFWJWHEKOUFL-UHFFFAOYSA-N |
Molecular Weight |
289.463 g/mol |
SMILES |
C(N(CCC)C(CCC)C)(=O)C=1C=CC(=CC1)C(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951525 |