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5-(acetoxymethyl)-7-bromo-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid methyl ester
SpectraBase Compound ID J1w2x8s1vzw
InChI InChI=1S/C17H15BrFNO5/c1-8(21)25-7-11-14-13(5-12(18)15(11)19)20(9-3-4-9)6-10(16(14)22)17(23)24-2/h5-6,9H,3-4,7H2,1-2H3
InChIKey ROXAZGLFYFEUCF-UHFFFAOYSA-N
Mol Weight 412.21 g/mol
Molecular Formula C17H15BrFNO5
Exact Mass 411.011764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49NSmhXdDM
Name 5-(acetoxymethyl)-7-bromo-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15BrFNO5
InChI InChI=1S/C17H15BrFNO5/c1-8(21)25-7-11-14-13(5-12(18)15(11)19)20(9-3-4-9)6-10(16(14)22)17(23)24-2/h5-6,9H,3-4,7H2,1-2H3
InChIKey ROXAZGLFYFEUCF-UHFFFAOYSA-N
Molecular Weight 412.211 g/mol
SMILES C=1N(c2cc(c(c(c2C(C1C(=O)OC)=O)COC(=O)C)F)Br)C1CC1
SPLASH splash10-00ri-0009000000-6698ac745e52790ea53b
Source of Spectrum E1-43-2251-15
Synonyms 5-(acetyloxymethyl)-7-bromo-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid methyl ester Methyl 5-(acetoxymethyl)-7-bromo-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylate Methyl 5-(acetyloxymethyl)-7-bromanyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Methyl 5-(acetyloxymethyl)-7-bromo-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylate
Wiley ID 1553176