| SpectraBase Spectrum ID |
DikmwDjuvXs |
| Name |
4-Acetyl-5-(2,4-dimethoxyphenyl)-3-hydroxy-1-[3-(4-morpholinyl)propyl]-1,5-dihydro-2H-pyrrol-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.194736624 u |
| Formula |
C21H28N2O6 |
| InChI |
InChI=1S/C21H28N2O6/c1-14(24)18-19(16-6-5-15(27-2)13-17(16)28-3)23(21(26)20(18)25)8-4-7-22-9-11-29-12-10-22/h5-6,13,19,25H,4,7-12H2,1-3H3 |
| InChIKey |
IGYYKKFDFAGRHP-UHFFFAOYSA-N |
| Molecular Weight |
404.463 g/mol |
| SMILES |
C1(C2=C(OC)C=C(C=C2)OC)C(=C(O)C(N1CCCN1CCOCC1)=O)C(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902629 |
![4-Acetyl-5-(2,4-dimethoxyphenyl)-3-hydroxy-1-[3-(4-morpholinyl)propyl]-1,5-dihydro-2H-pyrrol-2-one](/api/spectrum/DikmwDjuvXs/structure.png?h=300&w=458 "4-Acetyl-5-(2,4-dimethoxyphenyl)-3-hydroxy-1-[3-(4-morpholinyl)propyl]-1,5-dihydro-2H-pyrrol-2-one")
