SpectraBase Spectrum ID |
7quDxD2BL57 |
Name |
but-2-Enoylamide, 3-methyl-N-propyl-N-dodecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
309.303164879 u |
Formula |
C20H39NO |
InChI |
InChI=1S/C20H39NO/c1-5-7-8-9-10-11-12-13-14-15-17-21(16-6-2)20(22)18-19(3)4/h18H,5-17H2,1-4H3 |
InChIKey |
OFEVCJSHOMEWJF-UHFFFAOYSA-N |
Molecular Weight |
309.538 g/mol |
SMILES |
C(=O)(N(CCC)CCCCCCCCCCCC)C=C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927721 |