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1,3,5-Trifluoro-2,4,6-tris(4-tolylthio)-benzene

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1,3,5-Trifluoro-2,4,6-tris(4-tolylthio)-benzene
SpectraBase Compound ID A26zwGeswcP
InChI InChI=1S/C27H21F3S3/c1-16-4-10-19(11-5-16)31-25-22(28)26(32-20-12-6-17(2)7-13-20)24(30)27(23(25)29)33-21-14-8-18(3)9-15-21/h4-15H,1-3H3
InChIKey WLTPJFWXUPQPAL-UHFFFAOYSA-N
Mol Weight 498.64 g/mol
Molecular Formula C27H21F3S3
Exact Mass 498.075749 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JNlfThN49O2
Name 1,3,5-Trifluoro-2,4,6-tris(4-tolylthio)-benzene
CAS Registry Number 107540-19-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H21F3S3
InChI InChI=1S/C27H21F3S3/c1-16-4-10-19(11-5-16)31-25-22(28)26(32-20-12-6-17(2)7-13-20)24(30)27(23(25)29)33-21-14-8-18(3)9-15-21/h4-15H,1-3H3
InChIKey WLTPJFWXUPQPAL-UHFFFAOYSA-N
Literature Reference T.D. Stack, R.H. Holm, J. Am. Chem. Soc. 110, 2484 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3