(+/-)-2-MERCAPTOMETHYL-4-(4-METHYLPHENYL)-4-OXOBUTANOIC-ACID-AMMONIUM-SALT;KETO-FORM
Compound with spectra: 1 NMR
| SpectraBase Compound ID | IqT3TFICgI8 |
|---|---|
| InChI | InChI=1S/C12H14O3S.H3N/c1-8-2-4-9(5-3-8)11(13)6-10(7-16)12(14)15;/h2-5,10,16H,6-7H2,1H3,(H,14,15);1H3 |
| InChIKey | BKBLQWOAMZCBEM-UHFFFAOYSA-N |
| Mol Weight | 251.3 g/mol |
| Molecular Formula | C12H13NO3S |
| Exact Mass | 251.061614 g/mol |
| Parent InChIKey | ISPKDSLVVZZSLC-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
4-(4-Chlorophenyl)-2-methyl-4-oxobutanoic acid methyl ester
4-(1-oxo-3-Methylbutyl)-4'-bromobiphenyl
4-(4-Butoxyphenyl)-4-oxobutyric acid
4-[4-Methoxyphenyl]-2,4-dioxobutyric acid
3-(p-Phenoxybenzoyl)propionic acid
3-[p-(Hexadecyloxy)benzoyl]propionic acid
4-Methylpentedrone
3-(Benzoylmethyl)heptanoic acid
3-Phenyl-1-(4-(trifluoromethyl)phenyl)propan-1-one
2-Methyl-1-(4-methylphenyl)-3-phenyl-1-propanone
| Title | Journal or Book | Year |
|---|---|---|
| Synthesis and Antirheumatic Activity of the Metabolites of Esonarimod | Bioorganic & Medicinal Chemistry | 2002 |