| SpectraBase Spectrum ID |
6jvCM5ddBu4 |
| Name |
3-(Benzo[D][1,3]dioxol-5-yl)-2-(2-nitrophenyl)thiazolidin-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.046692663 u |
| Formula |
C16H12N2O5S |
| InChI |
InChI=1S/C16H12N2O5S/c19-15-8-24-16(11-3-1-2-4-12(11)18(20)21)17(15)10-5-6-13-14(7-10)23-9-22-13/h1-7,16H,8-9H2 |
| InChIKey |
MUMQYFIRABGOCW-UHFFFAOYSA-N |
| Molecular Weight |
344.341 g/mol |
| SMILES |
C1C(N(C(S1)C1=C(C=CC=C1)[N+]([O-])=O)C1=CC=C2C(OCO2)=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.84138 |
![3-(Benzo[d][1,3]dioxol-5-yl)-2-(2-nitrophenyl)thiazolidin-4-one](/api/spectrum/6jvCM5ddBu4/structure.png?h=300&w=458 "3-(Benzo[d][1,3]dioxol-5-yl)-2-(2-nitrophenyl)thiazolidin-4-one")
