Vitas-M small molecule compound

3-methyl-1-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]pyridinium

Catalog ID
STL320833
SMILES Cc1cc(C)c(c(c1)C)C(=O)C[n+]1cccc(c1)C

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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 C17H20NO MW 254.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20NO/c1-12-6-5-7-18(10-12)11-16(19)17-14(3)8-13(2)9-15(17)4/h5-10H,11H2,1-4H3/q+1
InChIKey
LJAUNKNRHGCRMY-UHFFFAOYSA-N
Synonyms

2(3METHYLPYRIDIN1IUM1YL)1(246TRIMETHYLPHENYL)ETHANONE
3methyl1(2oxo2(246trimethylphenyl)ethyl)pyridinium
CC1=C(N+)(=CC=C1)CC(=O)C2=C(C=C(C=C2C)C)C
Cc1cc(C)c(c(c1)C)C(=O)C(n+)1cccc(c1)C
InChI=1SC17H20NOc11265718(1012)1116(19)1714(3)813(2)915(17)4h510H11H214H3q+1
MFCD01084663
ZINC000001902369
ZINC01902369
ZINC1902369

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Available files

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