| SpectraBase Spectrum ID |
6XEp4qA32ih |
| Name |
3,5-Dinitro-2-(phenylthio)benzoic acid |
| Alternate Name(s) |
3,5-Dinitro-2-phenylsulfanylbenzoic acid |
| CAS Registry Number |
70242-85-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H8N2O6S |
| InChI |
InChI=1S/C13H8N2O6S/c16-13(17)10-6-8(14(18)19)7-11(15(20)21)12(10)22-9-4-2-1-3-5-9/h1-7H,(H,16,17) |
| InChIKey |
QGWKJRFLRKBPIM-UHFFFAOYSA-N |
| Molecular Weight |
320.275 g/mol |
| SMILES |
OC(c1c(c(N(=O)=O)cc(N(=O)=O)c1)Sc1ccccc1)=O |
| SPLASH |
splash10-00fr-3927000000-8fbc26f7578c5ad0ef96 |
| Source of Spectrum |
J-51-3020-0 |
| Wiley ID |
1319730 |
