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1-Ethyl-6-fluoro-7-(5-morpholino-2,3,4-triazabicyclo[5.3.0]dec-2-en-4-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
SpectraBase Compound ID BUaOpcvvFYJ
InChI InChI=1S/C23H28FN5O4/c1-2-27-13-16(23(31)32)22(30)15-11-17(24)20(12-19(15)27)29-21(28-6-8-33-9-7-28)10-14-4-3-5-18(14)25-26-29/h11-14,18,21H,2-10H2,1H3,(H,31,32)
InChIKey OGIFZXKINVJUCT-UHFFFAOYSA-N
Mol Weight 457.51 g/mol
Molecular Formula C23H28FN5O4
Exact Mass 457.212533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BZokIj3DtD
Name 1-Ethyl-6-fluoro-7-(5-morpholino-2,3,4-triazabicyclo[5.3.0]dec-2-en-4-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
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Formula C23H28FN5O4
InChI InChI=1S/C23H28FN5O4/c1-2-27-13-16(23(31)32)22(30)15-11-17(24)20(12-19(15)27)29-21(28-6-8-33-9-7-28)10-14-4-3-5-18(14)25-26-29/h11-14,18,21H,2-10H2,1H3,(H,31,32)
InChIKey OGIFZXKINVJUCT-UHFFFAOYSA-N
Molecular Weight 457.506 g/mol
SMILES OC(C=1C(c2cc(c(N3N=NC4CCCC4CC3N3CCOCC3)cc2N(C1)CC)F)=O)=O
SPLASH splash10-0gbc-0390000000-982d2e956b0d7042f894
Source of Spectrum O1-34-439-2
Synonyms 1-Ethyl-6-fluoro-7-(4-(4-morpholinyl)-5,5a,6,7,8,8a-hexahydrocyclopenta[d][1,2,3]triazepin-3(4H)-yl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
Wiley ID 819383