John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Sx8jrV68Fd SpectraBase Spectrum ID=1J97LVh5Fw2

(accessed ).
(5S)-5-(2-(4-METHYLPHENYL)-1,3-THIAZOL-4-YL-METHYL)-2,2-BIS-(TRIFLUOROMETHYL)-1,3-DIOXOLAN-4-ONE
SpectraBase Compound ID Sx8jrV68Fd
InChI InChI=1S/C16H11F6NO3S/c1-8-2-4-9(5-3-8)12-23-10(7-27-12)6-11-13(24)26-14(25-11,15(17,18)19)16(20,21)22/h2-5,7,11H,6H2,1H3/t11-/m1/s1
InChIKey OLGZHGCGRDYADE-LLVKDONJSA-N
Mol Weight 411.32 g/mol
Molecular Formula C16H11F6NO3S
Exact Mass 411.036385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1J97LVh5Fw2
Name (5S)-5-(2-(4-METHYLPHENYL)-1,3-THIAZOL-4-YL-METHYL)-2,2-BIS-(TRIFLUOROMETHYL)-1,3-DIOXOLAN-4-ONE
Compound Number 7B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H11F6NO3S
InChI InChI=1S/C16H11F6NO3S/c1-8-2-4-9(5-3-8)12-23-10(7-27-12)6-11-13(24)26-14(25-11,15(17,18)19)16(20,21)22/h2-5,7,11H,6H2,1H3/t11-/m1/s1
InChIKey OLGZHGCGRDYADE-LLVKDONJSA-N
Literature Reference Author K.BURGER,E.WINDEISEN,E.HEISTRACHER,T.LANGE,A.A.H.ABDEL-ALEEM
Literature Reference Citation MH.CHEM.,133,41(2002)
Literature Reference DOI 10.1007/s007060270005
Molecular Weight 411.319 g/mol
Solvent CDCl3
Source File Reference UWKP5006
SpectraBase Batch ID CnRMUx9Psqo