![3-(3,5-Dithioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoic acid](/api/spectrum/69gVltR9TdQ/structure.png?h=300&w=458 "3-(3,5-Dithioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoic acid")
| SpectraBase Compound ID | C4E8N8SsNtl |
|---|---|
| InChI | InChI=1S/C9H5NO2S7/c11-3(12)1-2-10-4-6(13)16-18-8(4)15-9-5(10)7(14)17-19-9/h1-2H2,(H,11,12) |
| InChIKey | GATISVWBSUFAAA-UHFFFAOYSA-N |
| Mol Weight | 383.6 g/mol |
| Molecular Formula | C9H5NO2S7 |
| Exact Mass | 382.836527 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 69gVltR9TdQ |
|---|---|
| Name | 3-(3,5-Dithioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H5NO2S7 |
| InChI | InChI=1S/C9H5NO2S7/c11-3(12)1-2-10-4-6(13)16-18-8(4)15-9-5(10)7(14)17-19-9/h1-2H2,(H,11,12) |
| InChIKey | GATISVWBSUFAAA-UHFFFAOYSA-N |
| Molecular Weight | 383.564 g/mol |
| SMILES | OC(CCN1C2=C(SC3=C1C(=S)SS3)SSC2=S)=O |
| SPLASH | splash10-0gws-1149000000-2e1650e7cabd11199cf1 |
| Source of Spectrum | KC-0-3427-24 |
| Synonyms | 3-(3,5-dithioxo-3H,4H,5H-di[1,2]dithiolo[3,4-b:4,3-e][1,4]thiazin-4-yl)propanoic acid 3-[3,5-bis(sulfanylidene)-4-didithiolo[5,4-a:5',4'-e][1,4]thiazinyl]propanoic acid 3-[3,5-bis(sulfanylidene)didithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl]propanoic acid 3-(3,5-dithioxodidithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoic acid 3-[3,5-bis(sulfanylidene)di[1,2]dithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl]propanoic acid |
| Wiley ID | 831746 |