Vitas-M small molecule compound
5,5-dimethyl-3-[(4-methylbenzyl)amino]cyclohex-2-en-1-one
Catalog ID
STK068891
SMILES O=C1C=C(NCc2ccc(cc2)C)CC(C1)(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 C16H21NO MW 243.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO/c1-12-4-6-13(7-5-12)11-17-14-8-15(18)10-16(2,3)9-14/h4-8,17H,9-11H2,1-3H3InChIKey
YOLUKRFOGUTOCB-UHFFFAOYSA-NSynonyms
258877-52-0258877520
55DIMETHYL3((4METHYLBENZYL)AMINO)CYCLOHEX2EN1ONE
55DIMETHYL3((4METHYLPHENYL)METHYLAMINO)CYCLOHEX2EN1ONE
CC1=CC=C(C=C1)CNC2=CC(=O)CC(C2)(C)C
InChI=1SC16H21NOc1124613(7512)111714815(18)1016(23)914h4817H911H213H3
MFCD02911653
O=C1C=C(NCc2ccc(cc2)C)CC(C1)(C)C
STK068891
ZINC000000313741
ZINC00313741
ZINC313741
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