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6,12-Difluoro-2-(4-fluoro-phenyl)-benzo(H)quinolizino(4,5,6,7-fed)phenanthridinium cation
SpectraBase Compound ID FCES9hU5p16
InChI InChI=1S/C29H15F3N/c30-18-6-4-16(5-7-18)17-12-27-21-10-8-19(31)14-25(21)23-2-1-3-24-26-15-20(32)9-11-22(26)28(13-17)33(27)29(23)24/h1-15H/q+1
InChIKey NBKZKPVCLPHZGY-UHFFFAOYSA-N
Mol Weight 434.44 g/mol
Molecular Formula C29H15F3N
Exact Mass 434.115659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G6v3aG56ftw
Name 6,12-Difluoro-2-(4-fluoro-phenyl)-benzo(H)quinolizino(4,5,6,7-fed)phenanthridinium cation
CAS Registry Number 89419-53-4
Comments tetrafluoroborate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H15F3N
InChI InChI=1S/C29H15F3N/c30-18-6-4-16(5-7-18)17-12-27-21-10-8-19(31)14-25(21)23-2-1-3-24-26-15-20(32)9-11-22(26)28(13-17)33(27)29(23)24/h1-15H/q+1
InChIKey NBKZKPVCLPHZGY-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference A.R. Katritzky, B. Agha, G.Z. De Ville, Org. Magn. Resonance 21, 649 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6