| SpectraBase Spectrum ID |
4pGBrj3rM0s |
| Name |
Thiazolidin-2-thione, 4-methoxycarbonyl-3-phenylacetyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.033685628 u |
| Formula |
C13H13NO3S2 |
| InChI |
InChI=1S/C13H13NO3S2/c1-17-12(16)10-8-19-13(18)14(10)11(15)7-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3 |
| InChIKey |
PGJZZHHJTMKCSQ-UHFFFAOYSA-N |
| Molecular Weight |
295.371 g/mol |
| SMILES |
C1(CSC(N1C(CC1=CC=CC=C1)=O)=S)C(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864767 |
