SpectraBase Spectrum ID |
3nZWNHEg6GI |
Name |
Butyramide, 2-chloro-N-dodecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.217242353 u |
Formula |
C16H32ClNO |
InChI |
InChI=1S/C16H32ClNO/c1-3-5-6-7-8-9-10-11-12-13-14-18-16(19)15(17)4-2/h15H,3-14H2,1-2H3,(H,18,19) |
InChIKey |
VHEUFXHJORGMLJ-UHFFFAOYSA-N |
Molecular Weight |
289.891 g/mol |
SMILES |
C(=O)(NCCCCCCCCCCCC)C(CC)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929981 |