| SpectraBase Spectrum ID |
4JF6J1I73qS |
| Name |
but-2-Enoylamide, 3-methyl-N-(2-pentyl)-N-undecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
323.318814943 u |
| Formula |
C21H41NO |
| InChI |
InChI=1S/C21H41NO/c1-6-8-9-10-11-12-13-14-15-17-22(20(5)16-7-2)21(23)18-19(3)4/h18,20H,6-17H2,1-5H3 |
| InChIKey |
ZTXMICUBYWVGLD-UHFFFAOYSA-N |
| Molecular Weight |
323.565 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C=C(C)C)CCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900017 |
