| SpectraBase Spectrum ID |
4wd0KLDpPTl |
| Name |
4-Nitro-3(toluene-4-sulfonylmethyl)phenyl toluene-4-sulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H19NO7S2 |
| InChI |
InChI=1S/C21H19NO7S2/c1-15-3-8-19(9-4-15)30(25,26)14-17-13-18(7-12-21(17)22(23)24)29-31(27,28)20-10-5-16(2)6-11-20/h3-13H,14H2,1-2H3 |
| InChIKey |
GSNBDAXZYDMKFK-UHFFFAOYSA-N |
| Molecular Weight |
461.503 g/mol |
| SMILES |
c1(OS(c2ccc(cc2)C)(=O)=O)cc(CS(c2ccc(cc2)C)(=O)=O)c(N(=O)=O)cc1 |
| SPLASH |
splash10-0a4l-9704000000-4359756cedfae9eb0ed2 |
| Source of Spectrum |
F-53-4747-12 |
| Synonyms |
3-{[(4-methylphenyl)sulfonyl]methyl}-4-nitrophenyl 4-methylbenzenesulfonate |
| Wiley ID |
801392 |
