| SpectraBase Spectrum ID |
AmfouVuSFRi |
| Name |
Succinic acid, monoamide, N,N-di(2-ethylhexyl)-, heptyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.402544568 u |
| Formula |
C27H53NO3 |
| InChI |
InChI=1S/C27H53NO3/c1-6-11-14-15-16-21-31-27(30)20-19-26(29)28(22-24(9-4)17-12-7-2)23-25(10-5)18-13-8-3/h24-25H,6-23H2,1-5H3 |
| InChIKey |
FMTOHNQXMTZYOK-UHFFFAOYSA-N |
| Molecular Weight |
439.725 g/mol |
| SMILES |
C(CN(C(CCC(OCCCCCCC)=O)=O)CC(CCCC)CC)(CCCC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962567 |
