| SpectraBase Spectrum ID |
3hH9TUz0XVY |
| Name |
2-Nitro-5-(toluene-4-sulfonylmethyl)phenyl toluene-4-sulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19NO7S2 |
| InChI |
InChI=1S/C21H19NO7S2/c1-15-3-8-18(9-4-15)30(25,26)14-17-7-12-20(22(23)24)21(13-17)29-31(27,28)19-10-5-16(2)6-11-19/h3-13H,14H2,1-2H3 |
| InChIKey |
HTKHHXHFNOKWAE-UHFFFAOYSA-N |
| Molecular Weight |
461.503 g/mol |
| SMILES |
c1(ccc(cc1)S(=O)(=O)Oc1c(ccc(c1)CS(=O)(=O)c1ccc(cc1)C)N(=O)=O)C |
| SPLASH |
splash10-052o-7921100000-0eaf561ad7f6eb6926f8 |
| Source of Spectrum |
F-53-4745-4 |
| Synonyms |
5-{[(4-methylphenyl)sulfonyl]methyl}-2-nitrophenyl 4-methylbenzenesulfonate |
| Wiley ID |
801408 |
