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1,5-Bis(2-fluoro-9-acridinylthio)-pentane dication

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1,5-Bis(2-fluoro-9-acridinylthio)-pentane dication
SpectraBase Compound ID 4ouQXEHyNJM
InChI InChI=1S/C31H24F2N2S2/c32-20-12-14-28-24(18-20)30(22-8-2-4-10-26(22)34-28)36-16-6-1-7-17-37-31-23-9-3-5-11-27(23)35-29-15-13-21(33)19-25(29)31/h2-5,8-15,18-19H,1,6-7,16-17H2/p+2
InChIKey XTTLKQXFHFUVCX-UHFFFAOYSA-P
Mol Weight 528.68 g/mol
Molecular Formula C31H26F2N2S2
Exact Mass 528.150548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5ucWzAq0M24
Name 1,5-Bis(2-fluoro-9-acridinylthio)-pentane dication
Comments EXTERNAL LOCK
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H26F2N2S2
InChI InChI=1S/C31H24F2N2S2/c32-20-12-14-28-24(18-20)30(22-8-2-4-10-26(22)34-28)36-16-6-1-7-17-37-31-23-9-3-5-11-27(23)35-29-15-13-21(33)19-25(29)31/h2-5,8-15,18-19H,1,6-7,16-17H2/p+2
InChIKey XTTLKQXFHFUVCX-UHFFFAOYSA-P
Instrument Name Bruker AM-200
Literature Reference R. Faure, P. Poulallion, J.P.Galy, Magn. Res. Chem. 23, 991 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CF3COOH