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(Z)-4-((6-Ethoxy-3-oxobenzofuran-2(3H)-ylidene)methyl)-1-(2-oxo-2-p-tolylethyl)pyridinium chloride
SpectraBase Compound ID HHZLbyHG8Ac
InChI InChI=1S/C25H22NO4.ClH/c1-3-29-20-8-9-21-23(15-20)30-24(25(21)28)14-18-10-12-26(13-11-18)16-22(27)19-6-4-17(2)5-7-19;/h4-15H,3,16H2,1-2H3;1H/q+1;/p-1/b24-14-;
InChIKey GGQOLWKUDOIRKZ-LTMIIBIKSA-M
Mol Weight 435.91 g/mol
Molecular Formula C25H22ClNO4
Exact Mass 435.123736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8zBHrLU8jBo
Name (Z)-4-((6-Ethoxy-3-oxobenzofuran-2(3H)-ylidene)methyl)-1-(2-oxo-2-p-tolylethyl)pyridinium chloride
Alternate Name(s) (Z)-4-((6-ethoxy-3-oxobenzofuran-2(3H)-ylidene)methyl)-1-(2-oxo-2-(p-tolyl)ethyl)pyridin-1-ium chloride (2Z)-6-ethoxy-2-[[1-[2-(4-methylphenyl)-2-oxoethyl]-4-pyridin-1-iumyl]methylidene]-3-benzofuranone;chloride (2Z)-6-ethoxy-2-[[1-[2-(4-methylphenyl)-2-oxoethyl]pyridin-1-ium-4-yl]methylidene]-1-benzofuran-3-one;chloride (2Z)-6-ethoxy-2-[[1-[2-oxo-2-(p-tolyl)ethyl]pyridin-1-ium-4-yl]methylene]benzofuran-3-one;chloride (2Z)-6-ethoxy-2-[[1-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-yl]methylidene]-1-benzofuran-3-one;chloride
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Formula C25H22ClNO4
InChI InChI=1S/C25H22NO4.ClH/c1-3-29-20-8-9-21-23(15-20)30-24(25(21)28)14-18-10-12-26(13-11-18)16-22(27)19-6-4-17(2)5-7-19;/h4-15H,3,16H2,1-2H3;1H/q+1;/p-1/b24-14-;
InChIKey GGQOLWKUDOIRKZ-LTMIIBIKSA-M
Molecular Weight 435.907 g/mol
SMILES C(C(c1ccc(C)cc1)=O)[n+]1ccc(cc1)\C=C\1Oc2c(C1=O)ccc(c2)OCC.[Cl-]
SPLASH splash10-014r-2590000000-575ec562146b7ab0e34a
Source of Spectrum APC-346-585-13a
Wiley ID 1769548