SpectraBase Spectrum ID |
1nFftxpd6Ch |
Name |
Carbonic acid, monoamide, N-decyl-, 2-ethylhexyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
313.298079498 u |
Formula |
C19H39NO2 |
InChI |
InChI=1S/C19H39NO2/c1-4-7-9-10-11-12-13-14-16-20-19(21)22-17-18(6-3)15-8-5-2/h18H,4-17H2,1-3H3,(H,20,21) |
InChIKey |
CKVOSVXJSINVDW-UHFFFAOYSA-N |
Molecular Weight |
313.526 g/mol |
SMILES |
C(NCCCCCCCCCC)(=O)OCC(CCCC)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952413 |