| SpectraBase Spectrum ID |
LMUWpYXA3RZ |
| Name |
3-(Benzo[D][1,3]dioxol-5-yl)-2-(4-(methylsulfonyl)phenyl)thiazolidin-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.039164930 u |
| Formula |
C17H15NO5S2 |
| InChI |
InChI=1S/C17H15NO5S2/c1-25(20,21)13-5-2-11(3-6-13)17-18(16(19)9-24-17)12-4-7-14-15(8-12)23-10-22-14/h2-8,17H,9-10H2,1H3 |
| InChIKey |
VUZNUQRRRAEJPQ-UHFFFAOYSA-N |
| Molecular Weight |
377.429 g/mol |
| SMILES |
C1(SCC(N1C1=CC=C2C(OCO2)=C1)=O)C=1C=CC(=CC1)S(=O)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.841591 |