| SpectraBase Compound ID | 8yDI40I6cSE |
|---|---|
| InChI | InChI=1S/C12H7NO4S/c14-13(15)8-5-6-10-9-3-1-2-4-11(9)18(16,17)12(10)7-8/h1-7H |
| InChIKey | YPRJLDUOGDQQAK-UHFFFAOYSA-N |
| Mol Weight | 261.25 g/mol |
| Molecular Formula | C12H7NO4S |
| Exact Mass | 261.009579 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DiEEsuV77JR |
|---|---|
| Name | 3-NITRODIBENZOTHIOPHENE SULFONE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H7NO4S |
| InChI | InChI=1S/C12H7NO4S/c14-13(15)8-5-6-10-9-3-1-2-4-11(9)18(16,17)12(10)7-8/h1-7H |
| InChIKey | YPRJLDUOGDQQAK-UHFFFAOYSA-N |
| Molecular Weight | 261.0094 |
| SMILES | c1cc2S(=O)(=O)c3cc(N(=O)=O)ccc3-c2cc1 |
| SPLASH | splash10-0wmr-9610000000-6a2013491870b59641ae |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |