| SpectraBase Spectrum ID |
E6chkq9dRxs |
| Name |
Oxalic acid, monoamide, N,N-bis(2-ethylhexyl)-, heptyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
411.371244439 u |
| Formula |
C25H49NO3 |
| InChI |
InChI=1S/C25H49NO3/c1-6-11-14-15-16-19-29-25(28)24(27)26(20-22(9-4)17-12-7-2)21-23(10-5)18-13-8-3/h22-23H,6-21H2,1-5H3 |
| InChIKey |
KQNQRRSUNQZYRL-UHFFFAOYSA-N |
| Molecular Weight |
411.671 g/mol |
| SMILES |
C(C(=O)OCCCCCCC)(N(CC(CC)CCCC)CC(CCCC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979626 |
