| SpectraBase Spectrum ID |
6n29elIhjEy |
| Name |
Benzamide, 4-methyl-N-(2-pentyl)-N-butyl- |
| 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/c1-5-7-13-18(15(4)8-6-2)17(19)16-11-9-14(3)10-12-16/h9-12,15H,5-8,13H2,1-4H3 |
| InChIKey |
GVFVBJRNMSYIND-UHFFFAOYSA-N |
| Molecular Weight |
261.409 g/mol |
| SMILES |
C1=CC(=CC=C1C(N(CCCC)C(CCC)C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937683 |
