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(E/Z)-1-[3-(1,3-Dioxan-2-yl)phenyl]-2,2,2-trifluoroethanone O-Tosyl Oxime
SpectraBase Compound ID 2udpT2uQ1N0
InChI InChI=1S/2C19H18F3NO5S/c2*1-13-6-8-16(9-7-13)29(24,25)28-23-17(19(20,21)22)14-4-2-5-15(12-14)18-26-10-3-11-27-18/h2*2,4-9,12,18H,3,10-11H2,1H3/b23-17+;23-17-
InChIKey BSUZPAKJPHTMMV-PBGJNZDMSA-N
Mol Weight 858.82 g/mol
Molecular Formula C38H36F6N2O10S2
Exact Mass 858.171557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ATvbws2DePC
Name (E/Z)-1-[3-(1,3-DIOXAN-2-YL)-PHENYL]-2,2,2-TRIFLUOROETHANONE-O-TOSYL-OXIME
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H36F6N2O10S2
InChI InChI=1S/2C19H18F3NO5S/c2*1-13-6-8-16(9-7-13)29(24,25)28-23-17(19(20,21)22)14-4-2-5-15(12-14)18-26-10-3-11-27-18/h2*2,4-9,12,18H,3,10-11H2,1H3/b23-17+;23-17-
InChIKey BSUZPAKJPHTMMV-PBGJNZDMSA-N
Literature Reference Author F.HENTSCHEL,B.RAIMER,G.KELTER,H.H.FIEBIG,F.SASSE,T.LINDEL
Literature Reference Citation EUR.J.ORG.CHEM.,2014,2120(2014)
Literature Reference DOI 10.1002/ejoc.201301717
Molecular Weight 858.822 g/mol
Solvent CDCl3
Source File Reference UWIR19584