SpectraBase Spectrum ID |
9tLjKeDESYT |
Name |
Benzamide, 4-butyl-N-methyl-N-pentyl- |
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/c1-4-6-8-14-18(3)17(19)16-12-10-15(11-13-16)9-7-5-2/h10-13H,4-9,14H2,1-3H3 |
InChIKey |
ARLFMDLXDQQQEQ-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
C1=C(C=CC(=C1)CCCC)C(N(CCCCC)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960278 |