SpectraBase Spectrum ID |
K6ILP1vrTtg |
Name |
L-5-oxo-1-Phenyl-2-thioxo-4-imidazolidineacetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
249.057197778 u |
Formula |
C11H11N3O2S |
InChI |
InChI=1S/C11H11N3O2S/c12-9(15)6-8-10(16)14(11(17)13-8)7-4-2-1-3-5-7/h1-5,8H,6H2,(H2,12,15)(H,13,17) |
InChIKey |
ZQGVIKNSDQBZSS-UHFFFAOYSA-N |
Molecular Weight |
249.288 g/mol |
SMILES |
C(C1NC(N(C1=O)C1=CC=CC=C1)=S)C(=O)N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983349 |