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DIANILINIUM 3-BROMOHEPTAFLUOROADIPATE
SpectraBase Compound ID GAPSZ3ndQcc
InChI InChI=1S/C6H2BrF7O4.2C6H7N/c7-5(12,3(8,9)1(15)16)6(13,14)4(10,11)2(17)18;2*7-6-4-2-1-3-5-6/h(H,15,16)(H,17,18);2*1-5H,7H2
InChIKey LCJSKQXZXYULGG-UHFFFAOYSA-N
Mol Weight 537.23 g/mol
Molecular Formula C18H16BrF7N2O4
Exact Mass 536.018167 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J15WftouvAz
Name DIANILINIUM 3-BROMOHEPTAFLUOROADIPATE
Comments SCALE INVERTED. -113.3, -111.6, -109.0, -107.2 WERE ASSIGNED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H16BrF7N2O4
InChI InChI=1S/C6H2BrF7O4.2C6H7N/c7-5(12,3(8,9)1(15)16)6(13,14)4(10,11)2(17)18;2*7-6-4-2-1-3-5-6/h(H,15,16)(H,17,18);2*1-5H,7H2
InChIKey LCJSKQXZXYULGG-UHFFFAOYSA-N
Instrument Name Varian HA-100
Literature Reference T.W.BASTOCK, M.E.HARLEY, A.E.PEDLER, J.C.TATLOW (1975) J.Fluor.Chem.: v.6, N4,331-355.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl