| SpectraBase Spectrum ID |
KrSe4qgX0VI |
| Name |
Carbonic acid, monoamide, N-propyl-N-isobutyl-, 2-ethylhexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
271.251129305 u |
| Formula |
C16H33NO2 |
| InChI |
InChI=1S/C16H33NO2/c1-6-9-10-15(8-3)13-19-16(18)17(11-7-2)12-14(4)5/h14-15H,6-13H2,1-5H3 |
| InChIKey |
XUUIQFIAZQIAJW-UHFFFAOYSA-N |
| Molecular Weight |
271.445 g/mol |
| SMILES |
C(=O)(OCC(CCCC)CC)N(CCC)CC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967016 |
