![Ethyl 3-(3-oxo-5-thioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoate](/api/spectrum/9OTb3QHAG7f/structure.png?h=300&w=458 "Ethyl 3-(3-oxo-5-thioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoate")
| SpectraBase Compound ID | 7DM5tJLYdWL |
|---|---|
| InChI | InChI=1S/C11H9NO3S6/c1-2-15-5(13)3-4-12-6-8(14)18-20-10(6)17-11-7(12)9(16)19-21-11/h2-4H2,1H3 |
| InChIKey | XFJSWJVXKWNCHP-UHFFFAOYSA-N |
| Mol Weight | 395.6 g/mol |
| Molecular Formula | C11H9NO3S6 |
| Exact Mass | 394.89067 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9OTb3QHAG7f |
|---|---|
| Name | Ethyl 3-(3-oxo-5-thioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoate |
| Alternate Name(s) | Ethyl 3-(3-oxo-5-thioxo-3H,4H,5H-di[1,2]dithiolo[3,4-b:4,3-e][1,4]thiazin-4-yl)propanoate 3-(5-oxo-3-sulfanylidene-4-didithiolo[5,4-a:5',4'-e][1,4]thiazinyl)propanoic acid ethyl ester Ethyl 3-(5-oxo-3-sulfanylidenedidithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoate Ethyl 3-(5-oxo-3-thioxo-didithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoate Ethyl 3-(5-oxidanylidene-3-sulfanylidene-di[1,2]dithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H9NO3S6 |
| InChI | InChI=1S/C11H9NO3S6/c1-2-15-5(13)3-4-12-6-8(14)18-20-10(6)17-11-7(12)9(16)19-21-11/h2-4H2,1H3 |
| InChIKey | XFJSWJVXKWNCHP-UHFFFAOYSA-N |
| Molecular Weight | 395.557 g/mol |
| SMILES | C12=C(N(CCC(=O)OCC)C3=C(S2)SSC3=S)C(=O)SS1 |
| SPLASH | splash10-052b-3349000000-82972bf8c064c230cf7b |
| Source of Spectrum | KC-0-3426-18 |
| Wiley ID | 831756 |