![Ethyl 3-(3,5-dioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propionate](/api/spectrum/Kbv8lFBNQRS/structure.png?h=300&w=458 "Ethyl 3-(3,5-dioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propionate")
| SpectraBase Compound ID | BfEXWW0lFXo |
|---|---|
| InChI | InChI=1S/C11H9NO4S5/c1-2-16-5(13)3-4-12-6-8(14)18-20-10(6)17-11-7(12)9(15)19-21-11/h2-4H2,1H3 |
| InChIKey | LBNZFSHDWNVSMZ-UHFFFAOYSA-N |
| Mol Weight | 379.5 g/mol |
| Molecular Formula | C11H9NO4S5 |
| Exact Mass | 378.913514 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Kbv8lFBNQRS |
|---|---|
| Name | Ethyl 3-(3,5-dioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propionate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H9NO4S5 |
| InChI | InChI=1S/C11H9NO4S5/c1-2-16-5(13)3-4-12-6-8(14)18-20-10(6)17-11-7(12)9(15)19-21-11/h2-4H2,1H3 |
| InChIKey | LBNZFSHDWNVSMZ-UHFFFAOYSA-N |
| Molecular Weight | 379.496 g/mol |
| SMILES | C12=C(N(CCC(=O)OCC)C3=C(S2)SSC3=O)C(=O)SS1 |
| SPLASH | splash10-0f96-5390000000-bfd98bd24acc52b7c799 |
| Source of Spectrum | KC-0-3426-17 |
| Synonyms | Ethyl 3-(3,5-dioxo-3H,4H,5H-di[1,2]dithiolo[3,4-b:4,3-e][1,4]thiazin-4-yl)propanoate 3-(3,5-dioxo-4-didithiolo[5,4-a:5',4'-e][1,4]thiazinyl)propanoic acid ethyl ester Ethyl 3-(3,5-dioxodidithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoate Ethyl 3-[3,5-bis(oxidanylidene)di[1,2]dithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl]propanoate |
| Wiley ID | 831757 |