| SpectraBase Spectrum ID |
EOeYva4pUZ3 |
| Name |
Valeramide, 2-methyl-N-(2-butyl)-N-octadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.444015458 u |
| Formula |
C28H57NO |
| InChI |
InChI=1S/C28H57NO/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-29(27(5)8-3)28(30)26(4)24-7-2/h26-27H,6-25H2,1-5H3 |
| InChIKey |
GCODMBTYZZLVTJ-UHFFFAOYSA-N |
| Molecular Weight |
423.770 g/mol |
| SMILES |
C(N(CCCCCCCCCCCCCCCCCC)C(CC)C)(=O)C(C)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918589 |
