| SpectraBase Spectrum ID |
6oQkTPQQCJB |
| Name |
Carbonic acid, monoamide, N-(2-pentyl)-N-(2-ethylhexyl)-, isobutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
299.282429433 u |
| Formula |
C18H37NO2 |
| InChI |
InChI=1S/C18H37NO2/c1-7-10-12-17(9-3)13-19(16(6)11-8-2)18(20)21-14-15(4)5/h15-17H,7-14H2,1-6H3 |
| InChIKey |
OTYZSROSODJSMM-UHFFFAOYSA-N |
| SMILES |
CCCC(C)N(C(OCC(C)C)=O)CC(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958488 |
