| SpectraBase Spectrum ID |
AJNqTuqbzFI |
| Name |
Hexanamide, 3,5,5-trimethyl-N-(2-pentyl)-N-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
241.240564621 u |
| Formula |
C15H31NO |
| InChI |
InChI=1S/C15H31NO/c1-8-9-13(3)16(7)14(17)10-12(2)11-15(4,5)6/h12-13H,8-11H2,1-7H3 |
| InChIKey |
IKYSYOFPTOXFHU-UHFFFAOYSA-N |
| Molecular Weight |
241.419 g/mol |
| SMILES |
C(N(C)C(CCC)C)(=O)CC(C)CC(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920895 |
