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4-(TRIFLUOROMETHYL)-PHENYL-4-TOLUENESULFONATE

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4-(TRIFLUOROMETHYL)-PHENYL-4-TOLUENESULFONATE
SpectraBase Compound ID 5BV18zb2Olw
InChI InChI=1S/C14H11F3O3S/c1-10-2-8-13(9-3-10)21(18,19)20-12-6-4-11(5-7-12)14(15,16)17/h2-9H,1H3
InChIKey RWSSHLZCTGTMOT-UHFFFAOYSA-N
Mol Weight 316.29 g/mol
Molecular Formula C14H11F3O3S
Exact Mass 316.0381 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3SBKSogw5gN
Name 4-(TRIFLUOROMETHYL)-PHENYL-4-TOLUENESULFONATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H11F3O3S
InChI InChI=1S/C14H11F3O3S/c1-10-2-8-13(9-3-10)21(18,19)20-12-6-4-11(5-7-12)14(15,16)17/h2-9H,1H3
InChIKey RWSSHLZCTGTMOT-UHFFFAOYSA-N
Literature Reference Author V.NUMMERT,V.MAEEMETS,M.PIIRSALU,I.A.KOPPEL
Literature Reference Citation MAGN.RES.CHEM.,50,696(2012)
Literature Reference DOI 10.1002/mrc.3864
Solvent CH3CN:CD3CN
Source File Reference UWLU82325