| SpectraBase Spectrum ID |
41uHpVV9nc |
| Name |
3-Nitro-2-(toluene-4-sulfonylmethyl)phenyl toluene-4-sulfonate |
| Alternate Name(s) |
2-{[(4-methylphenyl)sulfonyl]methyl}-3-nitrophenyl 4-methylbenzenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19NO7S2 |
| InChI |
InChI=1S/C21H19NO7S2/c1-15-6-10-17(11-7-15)30(25,26)14-19-20(22(23)24)4-3-5-21(19)29-31(27,28)18-12-8-16(2)9-13-18/h3-13H,14H2,1-2H3 |
| InChIKey |
BRBMVQGKWPWKMP-UHFFFAOYSA-N |
| Molecular Weight |
461.503 g/mol |
| SMILES |
c1(ccc(cc1)S(=O)(=O)Oc1c(c(ccc1)N(=O)=O)CS(=O)(=O)c1ccc(cc1)C)C |
| SPLASH |
splash10-0a4i-8906000000-a581bba5a18d377553bd |
| Source of Spectrum |
F-53-4746-8 |
| Wiley ID |
801402 |
