| SpectraBase Spectrum ID |
DovdCKdzFOg |
| Name |
2-Thioxoimidazolidine-1-carbothioic allylamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
201.039439714 u |
| Formula |
C7H11N3S2 |
| InChI |
InChI=1S/C7H11N3S2/c1-2-3-8-6(11)10-5-4-9-7(10)12/h2H,1,3-5H2,(H,8,11)(H,9,12) |
| InChIKey |
YRCZNEWHQLSWDT-UHFFFAOYSA-N |
| Molecular Weight |
201.306 g/mol |
| SMILES |
C(NCC=C)(=S)N1C(NCC1)=S |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.880333 |
