| SpectraBase Spectrum ID |
Gw91IvZKP6H |
| Name |
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-1-(methylthiomethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.088163554 u |
| Formula |
C10H16N2O3S |
| InChI |
InChI=1S/C10H16N2O3S/c1-4-10(5-2)7(13)11-9(15)12(6-16-3)8(10)14/h4-6H2,1-3H3,(H,11,13,15) |
| InChIKey |
QVXZMYYMGSYWEH-UHFFFAOYSA-N |
| Molecular Weight |
244.309 g/mol |
| SMILES |
C1(C(N(C(NC1=O)=O)CSC)=O)(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974436 |
