| SpectraBase Spectrum ID |
EDtoJgmpzvR |
| Name |
Butanoic acid, 2-iodo-3-[(4-methylphenyl)sulfonyl]-, methyl ester |
| CAS Registry Number |
117659-21-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15IO4S |
| InChI |
InChI=1S/C12H15IO4S/c1-8-4-6-10(7-5-8)18(15,16)9(2)11(13)12(14)17-3/h4-7,9,11H,1-3H3 |
| InChIKey |
JMVKBUJZLNJMAV-UHFFFAOYSA-N |
| Molecular Weight |
382.212 g/mol |
| SMILES |
C(S(c1ccc(cc1)C)(=O)=O)(C(C(=O)OC)I)C |
| SPLASH |
splash10-00kf-9220000000-d252a1ddd02832ab94e5 |
| Source of Spectrum |
KC-1988-1031-2 |
| Synonyms |
Methyl 2-iodo-3-(p-tolylsulphonyl)butyrate
Methyl 2-iodo-3-[(4-methylphenyl)sulfonyl]butanoate |
| Wiley ID |
1360341 |
