SpectraBase Spectrum ID |
IxtuRU8Y9E3 |
Name |
Carbonic acid, monoamide, N-(2-ethylhexyl)-, octyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
285.266779369 u |
Formula |
C17H35NO2 |
InChI |
InChI=1S/C17H35NO2/c1-4-7-9-10-11-12-14-20-17(19)18-15-16(6-3)13-8-5-2/h16H,4-15H2,1-3H3,(H,18,19) |
InChIKey |
SDTSBTXASHYMDS-UHFFFAOYSA-N |
SMILES |
C(NCC(CCCC)CC)(=O)OCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958374 |