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1-Ethyl-6-fluoro-7-(4-(naphthalen-1-ylsulfonyl)piperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
SpectraBase Compound ID FgFs7yYBVI9
InChI InChI=1S/C26H24FN3O5S/c1-2-28-16-20(26(32)33)25(31)19-14-21(27)23(15-22(19)28)29-10-12-30(13-11-29)36(34,35)24-9-5-7-17-6-3-4-8-18(17)24/h3-9,14-16H,2,10-13H2,1H3,(H,32,33)
InChIKey AMQFSJVGZQZFKI-UHFFFAOYSA-N
Mol Weight 509.55 g/mol
Molecular Formula C26H24FN3O5S
Exact Mass 509.14207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeMgJfsRz2b
Name 1-Ethyl-6-fluoro-7-(4-(naphthalen-1-ylsulfonyl)piperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Alternate Name(s) 1-ethyl-6-fluoro-7-[4-(1-naphthalenylsulfonyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid 1-ethyl-6-fluoro-7-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid 1-ethyl-6-fluoro-7-[4-(1-naphthylsulfonyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid 1-ethyl-6-fluoranyl-7-(4-naphthalen-1-ylsulfonylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C26H24FN3O5S
InChI InChI=1S/C26H24FN3O5S/c1-2-28-16-20(26(32)33)25(31)19-14-21(27)23(15-22(19)28)29-10-12-30(13-11-29)36(34,35)24-9-5-7-17-6-3-4-8-18(17)24/h3-9,14-16H,2,10-13H2,1H3,(H,32,33)
InChIKey AMQFSJVGZQZFKI-UHFFFAOYSA-N
Molecular Weight 509.552 g/mol
SMILES OC(C=1C(c2cc(c(cc2N(C1)CC)N1CCN(S(c2c3c(cccc3)ccc2)(=O)=O)CC1)F)=O)=O
SPLASH splash10-0a4i-0000090000-7ea516805ed172ffebbe
Source of Spectrum F2-46-5494-2a
Wiley ID 1690224