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N-[3,4,5-TRIS-(N-DODECAN-1-YLOXY)-BENZOYL]-2-AMINOETHANOL
SpectraBase Compound ID LH4O5IhB4Wa
InChI InChI=1S/C45H83NO5/c1-4-7-10-13-16-19-22-25-28-31-36-49-42-39-41(45(48)46-34-35-47)40-43(50-37-32-29-26-23-20-17-14-11-8-5-2)44(42)51-38-33-30-27-24-21-18-15-12-9-6-3/h39-40,47H,4-38H2,1-3H3,(H,46,48)
InChIKey OWSZRUMSJFADMU-UHFFFAOYSA-N
Mol Weight 718.2 g/mol
Molecular Formula C45H83NO5
Exact Mass 717.627125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JlH673PRAee
Name N-[3,4,5-TRIS-(N-DODECAN-1-YLOXY)-BENZOYL]-2-AMINOETHANOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H83NO5
InChI InChI=1S/C45H83NO5/c1-4-7-10-13-16-19-22-25-28-31-36-49-42-39-41(45(48)46-34-35-47)40-43(50-37-32-29-26-23-20-17-14-11-8-5-2)44(42)51-38-33-30-27-24-21-18-15-12-9-6-3/h39-40,47H,4-38H2,1-3H3,(H,46,48)
InChIKey OWSZRUMSJFADMU-UHFFFAOYSA-N
Literature Reference Author D.J.P.YEARDLEY,G.UNGAR,V.PERCEC,M.N.HOLERCA,G.JOHANSSON
Literature Reference Citation J.AM.CHEM.SOC.,122,1684(2000)
Literature Reference DOI 10.1021/ja993915q
Molecular Weight 718.158 g/mol
Solvent CDCl3
Source File Reference UWSI2011