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1,1,1,2,2-PENTAFLUORO-3,4,4-TRIS(BUTYLTHIO)BUT-3-ENE
SpectraBase Compound ID F6wASuj3ihd
InChI InChI=1S/C16H27F5S3/c1-4-7-10-22-13(15(17,18)16(19,20)21)14(23-11-8-5-2)24-12-9-6-3/h4-12H2,1-3H3
InChIKey SMCPNLXNIZQULM-UHFFFAOYSA-N
Mol Weight 410.56 g/mol
Molecular Formula C16H27F5S3
Exact Mass 410.119505 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5tZOcAXXb2
Name 1,1,1,2,2-PENTAFLUORO-3,4,4-TRIS(BUTYLTHIO)BUT-3-ENE
Comments SCALE INVERTED (DIRECT INDICATION IN THE PUBLICATION).
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H27F5S3
InChI InChI=1S/C16H27F5S3/c1-4-7-10-22-13(15(17,18)16(19,20)21)14(23-11-8-5-2)24-12-9-6-3/h4-12H2,1-3H3
InChIKey SMCPNLXNIZQULM-UHFFFAOYSA-N
Instrument Name Varian EM-360
Literature Reference CHANG-MING HU, ZE-QI XU (1989) J.Fluor.Chem.: v.42, N1, 69-80.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported