| SpectraBase Spectrum ID |
625WVEerijw |
| Name |
3-[(2S,3S)-4-Hydroxy-3-methyl-1-phenylbutan-2-yl]-5-methylthiazolidine-2,4-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
293.108564647 u |
| Formula |
C15H19NO3S |
| InChI |
InChI=1S/C15H19NO3S/c1-10(9-17)13(8-12-6-4-3-5-7-12)16-14(18)11(2)20-15(16)19/h3-7,10-11,13,17H,8-9H2,1-2H3/t10-,11?,13+/m1/s1 |
| InChIKey |
SOIFSEDIQJTRHU-XEEJXUNPSA-N |
| Molecular Weight |
293.381 g/mol |
| SMILES |
C1(N(C(C(S1)C)=O)[C@@](CC=1C=CC=CC1)([C@@](CO)(C)[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971116 |
![3-[(2S,3S)-4-Hydroxy-3-methyl-1-phenylbutan-2-yl]-5-methylthiazolidine-2,4-dione](/api/spectrum/625WVEerijw/structure.png?h=300&w=458 "3-[(2S,3S)-4-Hydroxy-3-methyl-1-phenylbutan-2-yl]-5-methylthiazolidine-2,4-dione")
