| SpectraBase Spectrum ID |
5YKsjIEK27k |
| Name |
Fumaric acid, monoamide, N,N-dinonyl-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
395.339944310 u |
| Formula |
C24H45NO3 |
| InChI |
InChI=1S/C24H45NO3/c1-4-7-9-11-13-15-17-21-25(22-18-16-14-12-10-8-5-2)23(26)19-20-24(27)28-6-3/h19-20H,4-18,21-22H2,1-3H3/b20-19+ |
| InChIKey |
DEFKCAASPUEDRP-FMQUCBEESA-N |
| Molecular Weight |
395.628 g/mol |
| SMILES |
C(N(C(\C=C\C(OCC)=O)=O)CCCCCCCCC)CCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940537 |
