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1-Adamantan-1-yl-6-chloro-7-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid,N methyl ester
SpectraBase Compound ID K5ygPSwQgrB
InChI InChI=1S/C21H21ClFNO3/c1-27-20(26)15-10-24(18-6-17(23)16(22)5-14(18)19(15)25)21-7-11-2-12(8-21)4-13(3-11)9-21/h5-6,10-13H,2-4,7-9H2,1H3/t11-,12+,13-,21-
InChIKey AEVSNLIOEOBXGP-UHFFFAOYSA-N
Mol Weight 389.85 g/mol
Molecular Formula C21H21ClFNO3
Exact Mass 389.119399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhNuaN2cdro
Name 1-Adamantan-1-yl-6-chloro-7-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid,N methyl ester
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Formula C21H21ClFNO3
InChI InChI=1S/C21H21ClFNO3/c1-27-20(26)15-10-24(18-6-17(23)16(22)5-14(18)19(15)25)21-7-11-2-12(8-21)4-13(3-11)9-21/h5-6,10-13H,2-4,7-9H2,1H3/t11-,12+,13-,21-
InChIKey AEVSNLIOEOBXGP-UHFFFAOYSA-N
Molecular Weight 389.854 g/mol
SMILES C1[C@]2(C[C@@]3(CC(N4c5c(C(C(C(=O)OC)=C4)=O)cc(c(F)c5)Cl)(C[C@]1(C3)[H])C2)[H])[H]
SPLASH splash10-000i-6900000000-de2669c6e4db39ab1973
Synonyms 1-(1-adamantyl)-6-chloro-7-fluoro-4-keto-quinoline-3-carboxylic acid methyl ester 1-(1-adamantyl)-6-chloro-7-fluoro-4-oxo-3-quinolinecarboxylic acid methyl ester Methyl 1-(1-adamantyl)-6-chloranyl-7-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Methyl 1-(1-adamantyl)-6-chloro-7-fluoro-4-oxo-1,4-dihydro-3-quinolinecarboxylate Methyl 1-(1-adamantyl)-6-chloro-7-fluoro-4-oxo-quinoline-3-carboxylate
Wiley ID 1474879