Vitas-M small molecule compound
2,4-diacetyl-5-hydroxy-5-methyl-3-(4-methylphenyl)cyclohexanone
Catalog ID
STK840158
SMILES Cc1ccc(cc1)C1C(C(=O)C)C(=O)CC(C1C(=O)C)(C)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H22O4 MW 302.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22O4/c1-10-5-7-13(8-6-10)16-15(11(2)19)14(21)9-18(4,22)17(16)12(3)20/h5-8,15-17,22H,9H2,1-4H3InChIKey
OVSACNJGYGVYJL-UHFFFAOYSA-NSynonyms
71954-38-611(4hydroxy4methyl6oxo2(ptolyl)cyclohexane13diyl)diethanone
24DIACETYL5HYDROXY5METHYL3(4METHYLPHENYL)CYCLOHEXAN1ONE
24diacetyl5hydroxy5methyl3(4methylphenyl)cyclohexanone
71954386
CC1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)C)(C)O)C(=O)C
CYCLOHEXANONE24DIACETYL5HYDROXY5METHYL3(4METHYLPHENYL)
InChI=1SC18H22O4c1105713(8610)1615(11(2)19)14(21)918(422)17(16)12(3)20h58151722H9H214H3
MFCD01032006
ZINC000020057449
ZINC000238923569
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