| SpectraBase Spectrum ID |
If3qFt4JnXT |
| Name |
4H-[1,3]Dithiolo[4,5-D]pyrimidine-5,7-dione, 2-(4,5-dimethyl-[1,3]dithiol-2-ylidene)-4,6-dimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
343.978162328 u |
| Formula |
C12H12N2O2S4 |
| InChI |
InChI=1S/C12H12N2O2S4/c1-5-6(2)18-10(17-5)11-19-7-8(15)13(3)12(16)14(4)9(7)20-11/h1-4H3 |
| InChIKey |
ZHYZLWFRVZJFOG-UHFFFAOYSA-N |
| Molecular Weight |
344.480 g/mol |
| SMILES |
C12=C(C(=O)N(C(N2C)=O)C)SC(S1)=C1SC(C)=C(C)S1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931979 |
![4H-[1,3]Dithiolo[4,5-D]pyrimidine-5,7-dione, 2-(4,5-dimethyl-[1,3]dithiol-2-ylidene)-4,6-dimethyl-](/api/spectrum/If3qFt4JnXT/structure.png?h=300&w=458 "4H-[1,3]Dithiolo[4,5-D]pyrimidine-5,7-dione, 2-(4,5-dimethyl-[1,3]dithiol-2-ylidene)-4,6-dimethyl-")
