Vitas-M small molecule compound
2-[(1E)-3-oxobut-1-en-1-yl]quinolinium
Catalog ID
STL058853
SMILES CC(=O)/C=C/c1ccc2c([nH+]1)cccc2
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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 C13H12NO MW 198.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11NO/c1-10(15)6-8-12-9-7-11-4-2-3-5-13(11)14-12/h2-9H,1H3/p+1/b8-6+InChIKey
ZFAXBDTVRSPYNB-SOFGYWHQSA-OSynonyms
(E)2(3oxobut1en1yl)quinolin1iumchloride
(E)4QUINOLIN1IUM2YLBUT3EN2ONE
2((1E)3oxobut1en1yl)quinolinium
CC(=O)C=CC1=(NH+)C2=CC=CC=C2C=C1
CC(=O)C=CC1=CC=c2c(=(NH+)1)cccc2(Cl)
CC(=O)C=Cc1ccc2c((nH+)1)cccc2
InChI=1SC13H11NOc110(15)68129711423513(11)1412h29H1H3p+1b86+
ZINC000012379248
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