For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(2-TRIFLUOROMETHYLPHENYL)-6-FLUORO-7-PIPERAZINYL-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC-ACID

View entire compound with spectra: 1 NMR

1-(2-TRIFLUOROMETHYLPHENYL)-6-FLUORO-7-PIPERAZINYL-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC-ACID
SpectraBase Compound ID 4iHv3yHmxBu
InChI InChI=1S/2C21H17F4N3O3/c2*22-15-9-12-17(10-18(15)27-7-5-26-6-8-27)28(11-13(19(12)29)20(30)31)16-4-2-1-3-14(16)21(23,24)25/h2*1-4,9-11,26H,5-8H2,(H,30,31)
InChIKey LJOVYXALSWEQAV-UHFFFAOYSA-N
Mol Weight 870.76 g/mol
Molecular Formula C42H34F8N6O6
Exact Mass 870.241208 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B69FtaEnJNo
Name 1-(2-TRIFLUOROMETHYLPHENYL)-6-FLUORO-7-PIPERAZINYL-4-OXO-1,4-DIHYDRO-QUINOLINE-3-CARBOXYLIC-ACID
Compound Number 6H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H34F8N6O6
InChI InChI=1S/2C21H17F4N3O3/c2*22-15-9-12-17(10-18(15)27-7-5-26-6-8-27)28(11-13(19(12)29)20(30)31)16-4-2-1-3-14(16)21(23,24)25/h2*1-4,9-11,26H,5-8H2,(H,30,31)
InChIKey LJOVYXALSWEQAV-UHFFFAOYSA-N
Literature Reference Author J.JUERGENS,H.SCHEDLETZKY,P.HEISIG,J.K.SEYDEL,B.WIEDEMANN,U.H OLZGRABE
Literature Reference Citation ARCH.PHARM.,329,179(1996)
Literature Reference DOI 10.1002/ardp.19963290403
Molecular Weight 870.756 g/mol
Solvent DMSO-D6
Source File Reference UWRU5443