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1-(o-Tolyl)-7-(piperazin-1'-yl)-3-(hydroxycarnonyl)-6-fluoro-1,4-dihydro-4-quinolone
SpectraBase Compound ID 5ajTgwn8ysI
InChI InChI=1S/C21H20FN3O3/c1-13-4-2-3-5-17(13)25-12-15(21(27)28)20(26)14-10-16(22)19(11-18(14)25)24-8-6-23-7-9-24/h2-5,10-12,23H,6-9H2,1H3,(H,27,28)
InChIKey UNDKSFYVMMPOSB-UHFFFAOYSA-N
Mol Weight 381.41 g/mol
Molecular Formula C21H20FN3O3
Exact Mass 381.14887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 51W95dIcL7D
Name 1-(o-Tolyl)-7-(piperazin-1'-yl)-3-(hydroxycarnonyl)-6-fluoro-1,4-dihydro-4-quinolone
Alternate Name(s) 6-Fluoro-1-(2-methylphenyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid 6-Fluoro-1-(2-methylphenyl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid 6-Fluoro-1-(o-tolyl)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid 6-Fluoranyl-1-(2-methylphenyl)-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid
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Formula C21H20FN3O3
InChI InChI=1S/C21H20FN3O3/c1-13-4-2-3-5-17(13)25-12-15(21(27)28)20(26)14-10-16(22)19(11-18(14)25)24-8-6-23-7-9-24/h2-5,10-12,23H,6-9H2,1H3,(H,27,28)
InChIKey UNDKSFYVMMPOSB-UHFFFAOYSA-N
Molecular Weight 381.407 g/mol
SMILES N1CCN(c2c(cc3c(N(C=C(C(=O)O)C3=O)c3c(C)cccc3)c2)F)CC1
SPLASH splash10-001a-0049000000-4e5f8768e2f1cc5b347e
Source of Spectrum D8-329-189-6
Wiley ID 1516149