| SpectraBase Spectrum ID |
4rCoog2DGoc |
| Name |
3-Ethyl-6-phenyl-2-sulfanylidene-1,3-thiazin-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
249.028206325 u |
| Formula |
C12H11NOS2 |
| InChI |
InChI=1S/C12H11NOS2/c1-2-13-11(14)8-10(16-12(13)15)9-6-4-3-5-7-9/h3-8H,2H2,1H3 |
| InChIKey |
RSDWMNJCIAEXFZ-UHFFFAOYSA-N |
| Molecular Weight |
249.346 g/mol |
| SMILES |
C1(SC(=CC(N1CC)=O)C=1C=CC=CC1)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811073 |
