SpectraBase Spectrum ID |
Cp3NIN5atF0 |
Name |
Hexanamide, N,N-dinonyl-6-chloro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
401.342442869 u |
Formula |
C24H48ClNO |
InChI |
InChI=1S/C24H48ClNO/c1-3-5-7-9-11-13-18-22-26(24(27)20-16-15-17-21-25)23-19-14-12-10-8-6-4-2/h3-23H2,1-2H3 |
InChIKey |
ARRDNVVGNRQBES-UHFFFAOYSA-N |
Molecular Weight |
402.107 g/mol |
SMILES |
CCCCCCCCCN(C(CCCCCCl)=O)CCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916237 |