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KXCITZRBQGPWAD-UHFFFAOYSA-N

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KXCITZRBQGPWAD-UHFFFAOYSA-N
SpectraBase Compound ID knSn3P06ar
InChI InChI=1S/C31H51F4N5O12/c32-26-25(27(33)29(35)30(28(26)34)39-40-37)31(41)38-2-4-43-6-8-45-10-12-47-14-16-49-18-20-51-22-24-52-23-21-50-19-17-48-15-13-46-11-9-44-7-5-42-3-1-36/h1-24,36H2,(H,38,41)
InChIKey KXCITZRBQGPWAD-UHFFFAOYSA-N
Mol Weight 761.8 g/mol
Molecular Formula C31H51F4N5O12
Exact Mass 761.347035 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AKIjgCKaeBn
Name KXCITZRBQGPWAD-UHFFFAOYSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H51F4N5O12
InChI InChI=1S/C31H51F4N5O12/c32-26-25(27(33)29(35)30(28(26)34)39-40-37)31(41)38-2-4-43-6-8-45-10-12-47-14-16-49-18-20-51-22-24-52-23-21-50-19-17-48-15-13-46-11-9-44-7-5-42-3-1-36/h1-24,36H2,(H,38,41)
InChIKey KXCITZRBQGPWAD-UHFFFAOYSA-N
Literature Reference Author P.A.WANG,S.Y.ZHANG,H.B.KAGAN
Literature Reference Citation BEIL.J.ORG.CHEM.,9,265(2013)
Literature Reference DOI 10.3762/bjoc.9.32
Molecular Weight 761.766 g/mol
Solvent CDCl3
Source File Reference UWLU76998