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4-(3-{[(4-fluorophenyl)imino]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)phenyl acetate
SpectraBase Compound ID 7TZgWpJPkqa
InChI InChI=1S/C21H19FN2O2/c1-14-12-17(13-23-19-6-4-18(22)5-7-19)15(2)24(14)20-8-10-21(11-9-20)26-16(3)25/h4-13H,1-3H3/b23-13+
InChIKey JSFLLULWSAVAAD-YDZHTSKRSA-N
Mol Weight 350.39 g/mol
Molecular Formula C21H19FN2O2
Exact Mass 350.143056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqhuR1z8Xoe
Name 4-(3-{[(4-fluorophenyl)imino]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)phenyl acetate
Alternate Name(s) 4-(3-{(E)-[(4-fluorophenyl)imino]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)phenyl acetate Acetic acid 4-[3-[(4-fluoro-phenylimino)-methyl]-2,5-dimethyl-pyrrol-1-yl]-phenyl ester
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Formula C21H19FN2O2
InChI InChI=1S/C21H19FN2O2/c1-14-12-17(13-23-19-6-4-18(22)5-7-19)15(2)24(14)20-8-10-21(11-9-20)26-16(3)25/h4-13H,1-3H3/b23-13+
InChIKey JSFLLULWSAVAAD-YDZHTSKRSA-N
Molecular Weight 350.393 g/mol
SMILES c1([n](c(c(c1)\C=N\c1ccc(cc1)F)C)-c1ccc(cc1)OC(=O)C)C
SPLASH splash10-0a4r-9837000000-843feee450541ecb38c3
Wiley ID 1452913