Vitas-M small molecule compound

3-cyano-1-methyl-3-(morpholin-4-yl)-1-azoniabicyclo[2.2.2]octane

Catalog ID
STK804517
SMILES N#CC1(C[N+]2(C)CCC1CC2)N1CCOCC1

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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 C13H22N3O MW 236.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H22N3O/c1-16-6-2-12(3-7-16)13(10-14,11-16)15-4-8-17-9-5-15/h12H,2-9,11H2,1H3/q+1
InChIKey
CYCZWAYOSRRYDY-UHFFFAOYSA-N
Synonyms

1METHYL3MORPHOLIN4YL1AZONIABICYCLO(222)OCTANE3CARBONITRILE
3cyano1methyl3(morpholin4yl)1azoniabicyclo(222)octane
3cyano1methyl3morpholinoquinuclidin1iumiodide
C(N+)12CCC(CC1)C(C2)(C#N)N3CCOCC3
InChI=1SC13H22N3Oc1166212(3716)13(10141116)1548179515h12H2911H21H3q+1
N#CC1(C(N+)2(C)CCC1CC2)N1CCOCC1
N#CC1(C(N+)2(C)CCC1CC2)N1CCOCC1(I)
ZINC000000178971
ZINC000000178973

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Available files

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