Vitas-M small molecule compound

(2Z)-2-(3-methylbutylidene)cyclohexanone

Catalog ID
STL300778
SMILES CC(C/C=C\1/CCCCC1=O)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 C11H18O MW 166.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H18O/c1-9(2)7-8-10-5-3-4-6-11(10)12/h8-9H,3-7H2,1-2H3/b10-8-
InChIKey
PNYNTSNMZRSAEP-NTMALXAHSA-N
Synonyms
300835-22-7
(2Z)2(3METHYLBUTYLIDENE)CYCLOHEXAN1ONE
(2Z)2(3methylbutylidene)cyclohexanone
(E)2(3methylbutylidene)cyclohexanone
300835227
CC(C)CC=C1CCCCC1=O
CC(CC=C1CCCCC1=O)C
InChI=1SC11H18Oc19(2)7810534611(10)12h89H37H212H3b108
MFCD00489787
ZINC000003164769
ZINC3164769

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Available files

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