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2-CHLORO-3,7-DIFLUORO-11-{4-[2-(4-FLUOROPHENYLETHYL)]PIPERAZINO}-10,11-DIHYDRODIBENZO[B,F]THIEPIN
SpectraBase Compound ID 11n6TurbyQS
InChI InChI=1S/C26H24ClF3N2S/c27-22-15-21-24(13-18-3-6-20(29)14-25(18)33-26(21)16-23(22)30)32-11-9-31(10-12-32)8-7-17-1-4-19(28)5-2-17/h1-6,14-16,24H,7-13H2
InChIKey GXTJFRPSRSMKPD-UHFFFAOYSA-N
Mol Weight 489.0 g/mol
Molecular Formula C26H24ClF3N2S
Exact Mass 488.130082 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASTUeFMLI8z
Name 2-CHLORO-3,7-DIFLUORO-11-{4-[2-(4-FLUOROPHENYLETHYL)]PIPERAZINO}-10,11-DIHYDRODIBENZO[B,F]THIEPIN
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H24ClF3N2S
InChI InChI=1S/C26H24ClF3N2S/c27-22-15-21-24(13-18-3-6-20(29)14-25(18)33-26(21)16-23(22)30)32-11-9-31(10-12-32)8-7-17-1-4-19(28)5-2-17/h1-6,14-16,24H,7-13H2
InChIKey GXTJFRPSRSMKPD-UHFFFAOYSA-N
Instrument Name Tesla BS487
Literature Reference V.BARTL, J.METYSOVA, M.PROTIVA (1981) Coll.Czech.Chem.Comm.: v.46, N1, 141-147.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d