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7-FLUORO-11-[4-(2-HYDROXYETHYL)PIPERAZINO]-2-ISOPROPYL-10,11-DIHYDRODIBENZO[B,F]THIEPIN
SpectraBase Compound ID Grl7XmDtvgm
InChI InChI=1S/C23H29FN2OS/c1-16(2)17-4-6-22-20(13-17)21(26-9-7-25(8-10-26)11-12-27)14-18-3-5-19(24)15-23(18)28-22/h3-6,13,15-16,21,27H,7-12,14H2,1-2H3
InChIKey XDBMBHVYXPBOPL-UHFFFAOYSA-N
Mol Weight 400.56 g/mol
Molecular Formula C23H29FN2OS
Exact Mass 400.198463 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 99bxMIimNpU
Name 7-FLUORO-11-[4-(2-HYDROXYETHYL)PIPERAZINO]-2-ISOPROPYL-10,11-DIHYDRODIBENZO[B,F]THIEPIN
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H29FN2OS
InChI InChI=1S/C23H29FN2OS/c1-16(2)17-4-6-22-20(13-17)21(26-9-7-25(8-10-26)11-12-27)14-18-3-5-19(24)15-23(18)28-22/h3-6,13,15-16,21,27H,7-12,14H2,1-2H3
InChIKey XDBMBHVYXPBOPL-UHFFFAOYSA-N
Instrument Name Tesla BS487
Literature Reference M.PROTIVA, J.JILEK, M.RAJSNER, J.POMYKACEK, M.RYSKA, J.HOLUBEK, E.SVATEK,J.METYSOVA (1986) Coll.Czech.Chem.Comm.: v.51, N3, 698-722.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d