| SpectraBase Compound ID | 8jgbxwMJlrm |
|---|---|
| InChI | InChI=1S/C7H5N3O4S/c8-7(15)4-1-5(9(11)12)3-6(2-4)10(13)14/h1-3H,(H2,8,15) |
| InChIKey | BMHGMJHFXHOFQU-UHFFFAOYSA-N |
| Mol Weight | 227.19 g/mol |
| Molecular Formula | C7H5N3O4S |
| Exact Mass | 227.000077 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 25iNMIb5INJ |
|---|---|
| Name | 3,5-DINITROTHIOBENZAMIDE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H5N3O4S |
| InChI | InChI=1S/C7H5N3O4S/c8-7(15)4-1-5(9(11)12)3-6(2-4)10(13)14/h1-3H,(H2,8,15) |
| InChIKey | BMHGMJHFXHOFQU-UHFFFAOYSA-N |
| Molecular Weight | 227.0000 |
| SMILES | NC(c1cc(N(=O)=O)cc(N(=O)=O)c1)=S |
| SPLASH | splash10-02t9-7900000000-f4aa0b7272593ccf91e0 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |