| SpectraBase Spectrum ID |
6XqoUXoHhL3 |
| Name |
Valeramide, 2-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 |
241.240564621 u |
| Formula |
C15H31NO |
| InChI |
InChI=1S/C15H31NO/c1-7-9-13(5)15(17)16(11-12(3)4)14(6)10-8-2/h12-14H,7-11H2,1-6H3 |
| InChIKey |
XQWYVRDHYQBXJI-UHFFFAOYSA-N |
| Molecular Weight |
241.419 g/mol |
| SMILES |
C(N(CC(C)C)C(CCC)C)(=O)C(CCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833303 |
