Vitas-M small molecule compound
1-(2-oxo-2-phenylethyl)-4-aza-1-azoniabicyclo[2.2.2]octane bromide
Catalog ID
STL115083
SMILES O=C(c1ccccc1)C[N+]12CCN(CC1)CC2.[Br-]
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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 C14H19BrN2O MW 311.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N2O.BrH/c17-14(13-4-2-1-3-5-13)12-16-9-6-15(7-10-16)8-11-16;/h1-5H,6-12H2;1H/q+1;/p-1InChIKey
QXAWFDUHKGRSSX-UHFFFAOYSA-MSynonyms
97301-06-91(2oxo2phenylethyl)4aza1azoniabicyclo(222)octanebromide
2(1aza4azoniabicyclo(222)octan4yl)1phenylethanonebromide
4AZA1AZONIABICYCLO(222)OCTANE1(2OXO2PHENYLETHYL)BROMIDE
97301069
C1C(N+)2(CCN1CC2)CC(=O)C3=CC=CC=C3(Br)
InChI=1SC14H19N2OBrHc1714(134213513)12169615(71016)81116h15H612H21Hq+1p1
MFCD01419544
O=C(c1ccccc1)C(N+)12CCN(CC1)CC2(Br)
ZINC000005318633
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