SpectraBase Spectrum ID |
5pKLMXjaPpf |
Name |
Valeramide, 2-propyl-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
297.303164879 u |
Formula |
C19H39NO |
InChI |
InChI=1S/C19H39NO/c1-4-7-8-9-10-11-12-13-14-17-20-19(21)18(15-5-2)16-6-3/h18H,4-17H2,1-3H3,(H,20,21) |
InChIKey |
DQHLIBYDWVXZCC-UHFFFAOYSA-N |
Molecular Weight |
297.527 g/mol |
SMILES |
CCCC(C(NCCCCCCCCCCC)=O)CCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973057 |