| SpectraBase Spectrum ID |
5XgnzoGj0AI |
| Name |
Dimethyl N-ethyl-2-oxo-5-phenylpyrrolidine-3,4-cis-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.126322711 u |
| Formula |
C16H19NO5 |
| InChI |
InChI=1S/C16H19NO5/c1-4-17-13(10-8-6-5-7-9-10)11(15(19)21-2)12(14(17)18)16(20)22-3/h5-9,11-13H,4H2,1-3H3/t11-,12+,13+/m0/s1 |
| InChIKey |
LNJRKJALQANLDY-YNEHKIRRSA-N |
| Molecular Weight |
305.330 g/mol |
| SMILES |
C1([C@@]([C@](C(=O)OC)([C@](N1CC)(C=1C=CC=CC1)[H])[H])(C(=O)OC)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960749 |
