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(E)-1-(2-(4-Fluorophenyl)-2-oxoethyl)-4-(3-(8-methoxy-2-oxo-2H-chromen-3-yl)-3-oxoprop-1-enyl)pyridinium bromide
SpectraBase Compound ID Fy25ZkJsJr5
InChI InChI=1S/C26H19FNO5.BrH/c1-32-24-4-2-3-19-15-21(26(31)33-25(19)24)22(29)10-5-17-11-13-28(14-12-17)16-23(30)18-6-8-20(27)9-7-18;/h2-15H,16H2,1H3;1H/q+1;/p-1/b10-5+;
InChIKey CDCBZPAZSWYRSG-OAZHBLANSA-M
Mol Weight 524.342 g/mol
Molecular Formula C26H19BrFNO5
Exact Mass 523.043064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiuD0AEOkN0
Name (E)-1-(2-(4-Fluorophenyl)-2-oxoethyl)-4-(3-(8-methoxy-2-oxo-2H-chromen-3-yl)-3-oxoprop-1-enyl)pyridinium bromide
Alternate Name(s) (E)-1-(2-(4-fluorophenyl)-2-oxoethyl)-4-(3-(8-methoxy-2-oxo-2H-chromen-3-yl)-3-oxoprop-1-en-1-yl)pyridin-1-ium bromide 3-[(E)-3-[1-[2-(4-fluorophenyl)-2-oxoethyl]-4-pyridin-1-iumyl]-1-oxoprop-2-enyl]-8-methoxy-1-benzopyran-2-one;bromide 3-[(E)-3-[1-[2-(4-fluorophenyl)-2-oxoethyl]pyridin-1-ium-4-yl]prop-2-enoyl]-8-methoxychromen-2-one;bromide 3-[(E)-3-[1-[2-(4-fluorophenyl)-2-oxo-ethyl]pyridin-1-ium-4-yl]prop-2-enoyl]-8-methoxy-chromen-2-one;bromide 3-[(E)-3-[1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-4-yl]prop-2-enoyl]-8-methoxy-chromen-2-one;bromide
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Formula C26H19BrFNO5
InChI InChI=1S/C26H19FNO5.BrH/c1-32-24-4-2-3-19-15-21(26(31)33-25(19)24)22(29)10-5-17-11-13-28(14-12-17)16-23(30)18-6-8-20(27)9-7-18;/h2-15H,16H2,1H3;1H/q+1;/p-1/b10-5+;
InChIKey CDCBZPAZSWYRSG-OAZHBLANSA-M
Molecular Weight 524.342 g/mol
SMILES C(C(c1ccc(cc1)F)=O)[n+]1ccc(cc1)\C=C\C(=O)C=1C(Oc2c(cccc2C1)OC)=O.[Br-]
SPLASH splash10-00di-3809200000-05fa1f136c2aad1b3384
Source of Spectrum APC-346-585-7d
Wiley ID 1769552