SpectraBase Spectrum ID |
8qq8Z1A3lDV |
Name |
N-14-Methylhexadecyl pyrrolidone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
323.318814943 u |
Formula |
C21H41NO |
InChI |
InChI=1S/C21H41NO/c1-3-20(2)16-13-11-9-7-5-4-6-8-10-12-14-18-22-19-15-17-21(22)23/h20H,3-19H2,1-2H3 |
InChIKey |
DYPHZCANLAQDGZ-UHFFFAOYSA-N |
Molecular Weight |
323.565 g/mol |
SMILES |
C1(N(CCC1)CCCCCCCCCCCCCC(CC)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955216 |