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TRANS-2,3,4,4-TETRAKIS(BENZYLTHIO)-1,1-BIS(TRIFLUOROMETHYL)-1,3-BUTADIENE
SpectraBase Compound ID IQfgo6d5edJ
InChI InChI=1S/C34H28F6S4/c35-33(36,37)31(34(38,39)40)29(41-21-25-13-5-1-6-14-25)30(42-22-26-15-7-2-8-16-26)32(43-23-27-17-9-3-10-18-27)44-24-28-19-11-4-12-20-28/h1-20H,21-24H2
InChIKey KCLBSWYBSZSBAI-UHFFFAOYSA-N
Mol Weight 678.8 g/mol
Molecular Formula C34H28F6S4
Exact Mass 678.097805 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CSMniRcSd2l
Name CIS-2,3,4,4-TETRAKIS(BENZYLTHIO)-1,1-BIS(TRIFLUOROMETHYL)-1,3-BUTADIENE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C34H28F6S4
InChI InChI=1S/C34H28F6S4/c35-33(36,37)31(34(38,39)40)29(41-21-25-13-5-1-6-14-25)30(42-22-26-15-7-2-8-16-26)32(43-23-27-17-9-3-10-18-27)44-24-28-19-11-4-12-20-28/h1-20H,21-24H2
InChIKey KCLBSWYBSZSBAI-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference M.MARUTA, N.ISHIKAWA (1979) J.Fluor.Chem.: v.13, N2, 111-122.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl