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10-[(4'-CYANO-[1,1'-BIPHENYL]-4-YL)-OXY]-DECYL-2-CYANOACETATE
SpectraBase Compound ID LrZREwAjuYT
InChI InChI=1S/C26H30N2O3/c27-18-17-26(29)31-20-8-6-4-2-1-3-5-7-19-30-25-15-13-24(14-16-25)23-11-9-22(21-28)10-12-23/h9-16H,1-8,17,19-20H2
InChIKey LXVCILAXNALCAQ-UHFFFAOYSA-N
Mol Weight 418.54 g/mol
Molecular Formula C26H30N2O3
Exact Mass 418.225643 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H6rnq5mpM8e
Name 10-[(4'-CYANO-[1,1'-BIPHENYL]-4-YL)-OXY]-DECYL-2-CYANOACETATE
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30N2O3
InChI InChI=1S/C26H30N2O3/c27-18-17-26(29)31-20-8-6-4-2-1-3-5-7-19-30-25-15-13-24(14-16-25)23-11-9-22(21-28)10-12-23/h9-16H,1-8,17,19-20H2
InChIKey LXVCILAXNALCAQ-UHFFFAOYSA-N
Literature Reference Author K.C.KRESS,M.KALLER,K.V.AXENOV,S.TUSSETSCHLAEGER,S.LASCHAT
Literature Reference Citation BEIL.J.ORG.CHEM.,8,371(2012)
Literature Reference DOI 10.3762/bjoc.8.40
Molecular Weight 418.536 g/mol
Solvent CDCl3
Source File Reference UWIR10156