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1-cyclopropyl-6-fluoranyl-7-[3-(hydroxymethyl)piperazin-1-yl]-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid
SpectraBase Compound ID B0V0NPemImF
InChI InChI=1S/C19H22FN3O4/c1-10-16-14(23(12-2-3-12)8-13(18(16)25)19(26)27)6-15(17(10)20)22-5-4-21-11(7-22)9-24/h6,8,11-12,21,24H,2-5,7,9H2,1H3,(H,26,27)
InChIKey MJSHHKAEGFKVDO-UHFFFAOYSA-N
Mol Weight 375.4 g/mol
Molecular Formula C19H22FN3O4
Exact Mass 375.159434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FLhG7cAUK
Name 1-cyclopropyl-6-fluoranyl-7-[3-(hydroxymethyl)piperazin-1-yl]-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid
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Formula C19H22FN3O4
InChI InChI=1S/C19H22FN3O4/c1-10-16-14(23(12-2-3-12)8-13(18(16)25)19(26)27)6-15(17(10)20)22-5-4-21-11(7-22)9-24/h6,8,11-12,21,24H,2-5,7,9H2,1H3,(H,26,27)
InChIKey MJSHHKAEGFKVDO-UHFFFAOYSA-N
Molecular Weight 375.400 g/mol
SMILES N1CCN(CC1CO)c1c(c(c2C(C(=CN(c2c1)C1CC1)C(=O)O)=O)C)F
SPLASH splash10-0007-9214000000-a3e90d913e462c501524
Source of Spectrum E1-43-2250-5
Synonyms 1-cyclopropyl-6-fluoro-4-keto-5-methyl-7-(3-methylolpiperazino)quinoline-3-carboxylic acid 1-cyclopropyl-6-fluoro-7-[3-(hydroxymethyl)-1-piperazinyl]-5-methyl-4-oxo-3-quinolinecarboxylic acid 1-cyclopropyl-6-fluoro-7-[3-(hydroxymethyl)piperazin-1-yl]-5-methyl-4-oxo-quinoline-3-carboxylic acid
Wiley ID 1553167