| SpectraBase Spectrum ID |
7gY74AnuTS0 |
| Name |
Carbonic acid, monoamide, N-(2-pentyl)-N-nonyl-, hexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
341.329379627 u |
| Formula |
C21H43NO2 |
| InChI |
InChI=1S/C21H43NO2/c1-5-8-10-12-13-14-15-18-22(20(4)17-7-3)21(23)24-19-16-11-9-6-2/h20H,5-19H2,1-4H3 |
| InChIKey |
HSZGXOJQFYYTBN-UHFFFAOYSA-N |
| Molecular Weight |
341.580 g/mol |
| SMILES |
CCCC(C)N(C(OCCCCCC)=O)CCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946082 |
