Vitas-M small molecule compound

2-butanoyl-3-(tert-butylamino)-5,5-dimethylcyclohex-2-en-1-one

Catalog ID
STL325520
SMILES CCCC(=O)C1=C(NC(C)(C)C)CC(CC1=O)(C)C

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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 C16H27NO2 MW 265.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H27NO2/c1-7-8-12(18)14-11(17-15(2,3)4)9-16(5,6)10-13(14)19/h17H,7-10H2,1-6H3
InChIKey
FGIOLUOAGJESBM-UHFFFAOYSA-N
Synonyms

2BUTANOYL3(TERTBUTYLAMINO)55DIMETHYLCYCLOHEX2EN1ONE
3(tertbutylamino)2butyryl55dimethylcyclohex2enone
CCCC(=O)C1=C(CC(CC1=O)(C)C)NC(C)(C)C
InChI=1SC16H27NO2c17812(18)1411(1715(23)4)916(56)1013(14)19h17H710H216H3
MFCD00512992
ZINC000100703891
ZINC100703891

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.