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1-Ethyl-6-fluoranyl-7-(3-oxa-2-azabicyclo[2.2.2]oct-5-en-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid
SpectraBase Compound ID LU8AwoSvQVG
InChI InChI=1S/C18H17FN2O4/c1-2-20-9-13(18(23)24)17(22)12-7-14(19)16(8-15(12)20)21-10-3-5-11(25-21)6-4-10/h3,5,7-11H,2,4,6H2,1H3,(H,23,24)
InChIKey ZCYAXHMEKTWYGE-UHFFFAOYSA-N
Mol Weight 344.34 g/mol
Molecular Formula C18H17FN2O4
Exact Mass 344.117235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8FexPaggpa
Name 1-Ethyl-6-fluoranyl-7-(3-oxa-2-azabicyclo[2.2.2]oct-5-en-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid
CAS Registry Number 117358-78-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17FN2O4
InChI InChI=1S/C18H17FN2O4/c1-2-20-9-13(18(23)24)17(22)12-7-14(19)16(8-15(12)20)21-10-3-5-11(25-21)6-4-10/h3,5,7-11H,2,4,6H2,1H3,(H,23,24)
InChIKey ZCYAXHMEKTWYGE-UHFFFAOYSA-N
Molecular Weight 344.342 g/mol
SMILES OC(C=1C(c2cc(F)c(N3OC4C=CC3CC4)cc2N(C1)CC)=O)=O
SPLASH splash10-005c-9310000000-6c58307f4f01a8d1c30d
Source of Spectrum Y-25-722-11
Synonyms 1-Ethyl-6-fluoro-4-keto-7-(3-oxa-2-azabicyclo[2.2.2]oct-5-en-2-yl)quinoline-3-carboxylic acid 1-Ethyl-6-fluoro-7-(3-oxa-2-azabicyclo[2.2.2]oct-5-en-2-yl)-4-oxo-3-quinolinecarboxylic acid 1-Ethyl-6-fluoro-7-(3-oxa-2-azabicyclo[2.2.2]oct-5-en-2-yl)-4-oxo-quinoline-3-carboxylic acid
Wiley ID 1337823