| SpectraBase Spectrum ID |
B0Nj735aqN1 |
| Name |
Carbonic acid, monoamide, N-(2-butyl)-N-pentyl-, 2-ethylhexyl 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/c1-6-10-12-14-19(16(5)8-3)18(20)21-15-17(9-4)13-11-7-2/h16-17H,6-15H2,1-5H3 |
| InChIKey |
AJKGAPAGOKJZGI-UHFFFAOYSA-N |
| SMILES |
C(N(CCCCC)C(CC)C)(=O)OCC(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.980618 |
