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CIS-{2-(2,4-DIFLUOROPHENYL)-2-[1H-IMIDAZOL-1-YL]-METHYL-1,3-DIOXOLANE-4-YL}-METHYL-METHANESULFONATE
SpectraBase Compound ID Aa2BtVkRYmV
InChI InChI=1S/C15H16F2N2O5S/c1-25(20,21)23-8-12-7-22-15(24-12,9-19-5-4-18-10-19)13-3-2-11(16)6-14(13)17/h2-6,10,12H,7-9H2,1H3/t12-,15+/m0/s1
InChIKey VUQSKJQHHDQFER-SWLSCSKDSA-N
Mol Weight 374.36 g/mol
Molecular Formula C15H16F2N2O5S
Exact Mass 374.074799 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HN2Q5e6BXXA
Name CIS-{2-(2,4-DIFLUOROPHENYL)-2-[1H-IMIDAZOL-1-YL]-METHYL-1,3-DIOXOLANE-4-YL}-METHYL-METHANESULFONATE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16F2N2O5S
InChI InChI=1S/C15H16F2N2O5S/c1-25(20,21)23-8-12-7-22-15(24-12,9-19-5-4-18-10-19)13-3-2-11(16)6-14(13)17/h2-6,10,12H,7-9H2,1H3/t12-,15+/m0/s1
InChIKey VUQSKJQHHDQFER-SWLSCSKDSA-N
Literature Reference Author D.R.CHAPMAN,L.BAUER
Literature Reference Citation J.HETCYCL.CHEM.,27,2053(1990)
Literature Reference DOI 10.1002/jhet.5570270738
Molecular Weight 374.359 g/mol
Solvent CDCl3
Source File Reference UWCP3328