Vitas-M small molecule compound

8-butyl-3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octane

Catalog ID
STL411955
SMILES CCCC[N+]1(C)C2CCC1CC(C2)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 C12H24NO MW 198.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H24NO/c1-3-4-7-13(2)10-5-6-11(13)9-12(14)8-10/h10-12,14H,3-9H2,1-2H3/q+1
InChIKey
FMTZROWZFMEUAH-UHFFFAOYSA-N
Synonyms

8butyl3hydroxy8methyl8azoniabicyclo(321)octane
8BUTYL8METHYL8AZONIABICYCLO(321)OCTAN3OL
8BUTYL8METHYL8AZONIABICYCLO(321)OCTANE3OL
CCCC(N+)1(C)C2CCC1CC(C2)O
CCCC(N+)1(C2CCC1CC(C2)O)C
InChI=1SC12H24NOc134713(2)105611(13)912(14)810h101214H39H212H3q+1
ZINC000100929451

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Available files

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