SpectraBase Spectrum ID |
4HGzXvhdw2d |
Name |
Hexanamide, N-hexanoyl-N-allyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
253.204179111 u |
Formula |
C15H27NO2 |
InChI |
InChI=1S/C15H27NO2/c1-4-7-9-11-14(17)16(13-6-3)15(18)12-10-8-5-2/h6H,3-5,7-13H2,1-2H3 |
InChIKey |
JEEDRMAFKMCJNJ-UHFFFAOYSA-N |
Molecular Weight |
253.386 g/mol |
SMILES |
C(CN(C(CCCCC)=O)C(CCCCC)=O)=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964962 |