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10-[(4'-CYANO-[1,1'-BIPHENYL]-4-YL)-OXY]-DECYL-METHYL-MALONATE
SpectraBase Compound ID IVhjlS5m5jE
InChI InChI=1S/C27H33NO5/c1-31-26(29)20-27(30)33-19-9-7-5-3-2-4-6-8-18-32-25-16-14-24(15-17-25)23-12-10-22(21-28)11-13-23/h10-17H,2-9,18-20H2,1H3
InChIKey CJHJEAIZLWUENV-UHFFFAOYSA-N
Mol Weight 451.6 g/mol
Molecular Formula C27H33NO5
Exact Mass 451.235873 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HA51l9Z9uhc
Name 10-[(4'-CYANO-[1,1'-BIPHENYL]-4-YL)-OXY]-DECYL-METHYL-MALONATE
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H33NO5
InChI InChI=1S/C27H33NO5/c1-31-26(29)20-27(30)33-19-9-7-5-3-2-4-6-8-18-32-25-16-14-24(15-17-25)23-12-10-22(21-28)11-13-23/h10-17H,2-9,18-20H2,1H3
InChIKey CJHJEAIZLWUENV-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 451.563 g/mol
Solvent CDCl3
Source File Reference UWIR10154