| SpectraBase Compound ID | 2HLEGqvAGwe |
|---|---|
| InChI | InChI=1S/C12H9NO4S/c14-8-5-6-12(10(15)7-8)18-11-4-2-1-3-9(11)13(16)17/h1-7,14-15H |
| InChIKey | ZWAQNMWCGMDRMM-UHFFFAOYSA-N |
| Mol Weight | 263.27 g/mol |
| Molecular Formula | C12H9NO4S |
| Exact Mass | 263.025229 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Gi09Sb6JPCL |
|---|---|
| Name | 4-((2-nitrophenyl)thio)benzene-1,3-diol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H9NO4S |
| InChI | InChI=1S/C12H9NO4S/c14-8-5-6-12(10(15)7-8)18-11-4-2-1-3-9(11)13(16)17/h1-7,14-15H |
| InChIKey | ZWAQNMWCGMDRMM-UHFFFAOYSA-N |
| Molecular Weight | 263.267 g/mol |
| SMILES | Oc1ccc(c(c1)O)Sc1ccccc1[N+]([O-])=O |
| SPLASH | splash10-0230-3910000000-1ea359a7a0f2d045ba87 |
| Source of Spectrum | JX-2015-2-210 |
| Wiley ID | 1721952 |