SpectraBase Spectrum ID |
K7NGgF61Ytn |
Name |
Benzamide, 4-methyl-N-(2-butyl)-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/c1-5-7-8-13-18(15(4)6-2)17(19)16-11-9-14(3)10-12-16/h9-12,15H,5-8,13H2,1-4H3 |
InChIKey |
JYIZVTSORLGVEW-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
C(N(CCCCC)C(CC)C)(=O)C=1C=CC(=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826711 |