Vitas-M small molecule compound

1-butyl-3-hydroxy-1-azoniabicyclo[2.2.2]octane

Catalog ID
STK697934
SMILES CCCC[N+]12CCC(CC1)C(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 C11H22NO MW 184.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H22NO/c1-2-3-6-12-7-4-10(5-8-12)11(13)9-12/h10-11,13H,2-9H2,1H3/q+1
InChIKey
WMGDKBLJUXTILP-UHFFFAOYSA-N
Synonyms

(1r4s)1butyl3hydroxyquinuclidin1iumbromide
(3R)1BUTYL3HYDROXY1AZONIABICYCLO(222)OCTANE
1BUTYL1AZONIABICYCLO(222)OCTAN3OL
1butyl3hydroxy1azoniabicyclo(222)octane
CCCC(N+)12CC(C@H)(CC1)C(C2)O(Br)
CCCC(N+)12CCC(CC1)C(C2)O
InChI=1SC11H22NOc1236127410(5812)11(13)912h101113H29H21H3q+1
MFCD03765618
ZINC000001759706
ZINC000001759707

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Available files

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