SpectraBase Spectrum ID |
9oFWUYmhoAJ |
Name |
Propanamide, 3-phenyl-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
303.256214686 u |
Formula |
C20H33NO |
InChI |
InChI=1S/C20H33NO/c1-2-3-4-5-6-7-8-9-13-18-21-20(22)17-16-19-14-11-10-12-15-19/h10-12,14-15H,2-9,13,16-18H2,1H3,(H,21,22) |
InChIKey |
YJXVGBVPFPEOCQ-UHFFFAOYSA-N |
SMILES |
C(NCCCCCCCCCCC)(=O)CCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942571 |