SpectraBase Spectrum ID |
4mfbycC7eQu |
Name |
Benzamide, N-(2-pentyl)-N-(3-methylbutyl)- |
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/c1-5-9-15(4)18(13-12-14(2)3)17(19)16-10-7-6-8-11-16/h6-8,10-11,14-15H,5,9,12-13H2,1-4H3 |
InChIKey |
JWMBAFKPUZQNDD-UHFFFAOYSA-N |
Molecular Weight |
261.409 g/mol |
SMILES |
CCCC(N(C(=O)C=1C=CC=CC1)CCC(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941355 |