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5-(BENZYL-AMINO)-1-CYCLOPROPYL-6,7,8-TRIFLUORO-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID 4M80esBFjgp
InChI InChI=1S/C22H19F3N2O3/c1-2-30-22(29)14-11-27(13-8-9-13)20-15(21(14)28)19(17(24)16(23)18(20)25)26-10-12-6-4-3-5-7-12/h3-7,11,13,26H,2,8-10H2,1H3
InChIKey DWRDNFXSCILLLP-UHFFFAOYSA-N
Mol Weight 416.4 g/mol
Molecular Formula C22H19F3N2O3
Exact Mass 416.134777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 87qpaemcR5C
Name 5-(BENZYL-AMINO)-1-CYCLOPROPYL-6,7,8-TRIFLUORO-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC-ACID-ETHYLESTER
CAS Registry Number 110872-04-3
Compound Number SF4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19F3N2O3
InChI InChI=1S/C22H19F3N2O3/c1-2-30-22(29)14-11-27(13-8-9-13)20-15(21(14)28)19(17(24)16(23)18(20)25)26-10-12-6-4-3-5-7-12/h3-7,11,13,26H,2,8-10H2,1H3
InChIKey DWRDNFXSCILLLP-UHFFFAOYSA-N
Literature Reference Author N.MUNIGELA,J.M.BABU,A.YERRAMILLI,P.VISHWESHWAR,G.Y.S.SIVA,N. M.VALAVALA
Literature Reference Citation SCI.PHARM.,77,67(2009)
Literature Reference DOI 10.3797/scipharm.0812-12
Molecular Weight 416.400 g/mol
Sample ID 2956
Solvent DMSO-D6