SpectraBase Spectrum ID |
1mI3OYpqqBW |
Name |
Benzamide, N-(2-butyl)-N-propyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.162314299 u |
Formula |
C14H21NO |
InChI |
InChI=1S/C14H21NO/c1-4-11-15(12(3)5-2)14(16)13-9-7-6-8-10-13/h6-10,12H,4-5,11H2,1-3H3 |
InChIKey |
DFAOSBJJEWQAFY-UHFFFAOYSA-N |
Molecular Weight |
219.328 g/mol |
SMILES |
C(N(CCC)C(CC)C)(=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963774 |