SpectraBase Spectrum ID |
4D8m1azbGzU |
Name |
Benzamide, 2-methyl-N-butyl-N-ethyl- |
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/c1-4-6-11-15(5-2)14(16)13-10-8-7-9-12(13)3/h7-10H,4-6,11H2,1-3H3 |
InChIKey |
VOTUIXHFUVALJX-UHFFFAOYSA-N |
Molecular Weight |
219.328 g/mol |
SMILES |
C1=CC=C(C(=C1)C)C(N(CC)CCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893997 |