SpectraBase Spectrum ID |
qAcgWughuE |
Name |
Dodecanamide, N-(hept-2-yl)- |
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/c1-4-6-8-9-10-11-12-13-15-17-19(21)20-18(3)16-14-7-5-2/h18H,4-17H2,1-3H3,(H,20,21) |
InChIKey |
HQLWZLQGNSXNPR-UHFFFAOYSA-N |
Molecular Weight |
297.527 g/mol |
SMILES |
C(NC(CCCCC)C)(=O)CCCCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926988 |