SpectraBase Spectrum ID |
FyTksgArpLW |
Name |
Hexanamide, 3,5,5-trimethyl-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
311.318814943 u |
Formula |
C20H41NO |
InChI |
InChI=1S/C20H41NO/c1-6-7-8-9-10-11-12-13-14-15-21-19(22)16-18(2)17-20(3,4)5/h18H,6-17H2,1-5H3,(H,21,22) |
InChIKey |
RPHQJIQPJUSBIL-UHFFFAOYSA-N |
Molecular Weight |
311.554 g/mol |
SMILES |
C(=O)(NCCCCCCCCCCC)CC(CC(C)(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960232 |