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4,4'-BIS(TRIFLUOROMETHYL)DICARBOCYANINE PERCHLORATE
SpectraBase Compound ID 8SoVlRAQNHz
InChI InChI=1S/C28H29F6N2.ClHO4/c1-25(2)21(35(5)19-13-9-11-17(23(19)25)27(29,30)31)15-7-8-16-22-26(3,4)24-18(28(32,33)34)12-10-14-20(24)36(22)6;2-1(3,4)5/h7-16,21H,1-6H3;(H,2,3,4,5)/q+1;/p-1/b15-7+,16-8+;
InChIKey RDYGAEXSUYKBIU-OBQHEISASA-M
Mol Weight 606.99 g/mol
Molecular Formula C28H29ClF6N2O4
Exact Mass 606.172004 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G8fkrUKneY4
Name 4,4'-BIS(TRIFLUOROMETHYL)DICARBOCYANINE PERCHLORATE
Comments '+' DIRECTION-LOW FIELD
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H29ClF6N2O4
InChI InChI=1S/C28H29F6N2.ClHO4/c1-25(2)21(35(5)19-13-9-11-17(23(19)25)27(29,30)31)15-7-8-16-22-26(3,4)24-18(28(32,33)34)12-10-14-20(24)36(22)6;2-1(3,4)5/h7-16,21H,1-6H3;(H,2,3,4,5)/q+1;/p-1/b15-7+,16-8+;
InChIKey RDYGAEXSUYKBIU-OBQHEISASA-M
Instrument Name Tesla BS487
Literature Reference V.I.TROITSKAYA, I.G.OKSENGENDLER, S.V.PAZENOK, M.S.LYUBICH, S.M.LARINA,L.M.YAGUPOL'SKY (1982) Khim.Heteroc.Soed.(Russ. Lang.): N1, 47-51.
NMR Standard BENZOTRIFLUORIDE (BT
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H7NO dimethylforma