Vitas-M small molecule compound

(2E)-2-benzylidene-1-azabicyclo[2.2.2]octan-3-one

Catalog ID
STK791130
SMILES O=C1C2CCN(/C/1=C/c1ccccc1)CC2

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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 C14H15NO MW 213.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15NO/c16-14-12-6-8-15(9-7-12)13(14)10-11-4-2-1-3-5-11/h1-5,10,12H,6-9H2/b13-10+
InChIKey
RBGFDYWXBIXLSF-JLHYYAGUSA-N
Synonyms
24123-89-5
(2E)2benzylidene1azabicyclo(222)octan3one
(Z)2benzylidenequinuclidin3one
24123895
2BENZYLIDENE1AZABICYCLO(222)OCTANE3ONE
2BENZYLIDENEQUINUCLIDIN3ONE
3QUINUCLIDINONE2BENZYLIDENE
C1CN2CCC1C(=O)C2=CC3=CC=CC=C3
InChI=1SC14H15NOc1614126815(9712)13(14)10114213511h151012H69H2b1310+
MFCD08274744
O=C1C2CCN(C1=Cc1ccccc1)CC2
ZINC000032581205
ZINC32581205

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Available files

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