SpectraBase Spectrum ID |
43gwgRghAXx |
Name |
Benzamide, 2,4-dimethyl-N-pentyl- |
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/c1-4-5-6-9-15-14(16)13-8-7-11(2)10-12(13)3/h7-8,10H,4-6,9H2,1-3H3,(H,15,16) |
InChIKey |
WWHZCIIPWYHLCU-UHFFFAOYSA-N |
Molecular Weight |
219.328 g/mol |
SMILES |
C(CNC(=O)C1=C(C)C=C(C)C=C1)CCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972263 |