| SpectraBase Spectrum ID |
LkmiJ6Patnr |
| Name |
Benzamide, 3-methyl-N-(2-pentyl)-N-isobutyl- |
| 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/c1-6-8-15(5)18(12-13(2)3)17(19)16-10-7-9-14(4)11-16/h7,9-11,13,15H,6,8,12H2,1-5H3 |
| InChIKey |
HZRPPZHJFMOXEE-UHFFFAOYSA-N |
| Molecular Weight |
261.409 g/mol |
| SMILES |
C(N(CC(C)C)C(CCC)C)(=O)C=1C=C(C=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932059 |
