| SpectraBase Spectrum ID |
GgIgJRxAw31 |
| Name |
(3S,4S)-1-Benzyl-3,4-dihydroxy-2,5-pyrrolidinedione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
221.068807834 u |
| Formula |
C11H11NO4 |
| InChI |
InChI=1S/C11H11NO4/c13-8-9(14)11(16)12(10(8)15)6-7-4-2-1-3-5-7/h1-5,8-9,13-14H,6H2/t8-,9-/m0/s1 |
| InChIKey |
IZBMPGFJNIDMRR-IUCAKERBSA-N |
| Molecular Weight |
221.212 g/mol |
| SMILES |
C1(N(C([C@]([C@@]1(O)[H])(O)[H])=O)CC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963404 |
