| SpectraBase Spectrum ID |
K9RBAm7Yacu |
| Name |
Benzoic acid, 2,2'-sulfonylbis[5-(1,1-dimethylethyl)-3-(1-methylethenyl)- |
| CAS Registry Number |
62558-14-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H34O6S |
| InChI |
InChI=1S/C28H34O6S/c1-15(2)19-11-17(27(5,6)7)13-21(25(29)30)23(19)35(33,34)24-20(16(3)4)12-18(28(8,9)10)14-22(24)26(31)32/h11-14H,1,3H2,2,4-10H3,(H,29,30)(H,31,32) |
| InChIKey |
TWVNLFNOGKPRMH-UHFFFAOYSA-N |
| Molecular Weight |
498.634 g/mol |
| SMILES |
OC(c1c(S(c2c(C(=O)O)cc(cc2C(=C)C)C(C)(C)C)(=O)=O)c(cc(c1)C(C)(C)C)C(=C)C)=O |
| SPLASH |
splash10-000t-0000900000-7e4218235a3421216459 |
| Source of Spectrum |
C-103-121-0 |
| Synonyms |
5-tert-Butyl-2-[4-tert-butyl-2-carboxy-6-(1-methylethenyl)phenyl]sulfonyl-3-(1-methylethenyl)benzoic acid
5-tert-Butyl-2-(4-tert-butyl-2-carboxy-6-prop-1-en-2-ylphenyl)sulfonyl-3-prop-1-en-2-ylbenzoic acid
5-tert-Butyl-2-(4-tert-butyl-2-carboxy-6-prop-1-en-2-yl-phenyl)sulfonyl-3-prop-1-en-2-yl-benzoic acid |
| Wiley ID |
1398572 |
