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(1S,2S)-[(9-[(N-METHYLDODECYLAMINO)-METHYL]-1,10-PHENANTHROLIN-2-YL)-METHYL]-EPHEDRINE
SpectraBase Compound ID VcwqbwzfR2
InChI InChI=1S/C37H52N4O/c1-5-6-7-8-9-10-11-12-13-17-26-40(3)27-33-24-22-30-20-21-31-23-25-34(39-36(31)35(30)38-33)28-41(4)29(2)37(42)32-18-15-14-16-19-32/h14-16,18-25,29,37,42H,5-13,17,26-28H2,1-4H3/t29-,37+/m0/s1
InChIKey MYHQZNFFSPMAGJ-LUPQGNFSSA-N
Mol Weight 568.9 g/mol
Molecular Formula C37H52N4O
Exact Mass 568.414112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DhGhta79OqJ
Name (1S,2S)-[(9-[(N-METHYLDODECYLAMINO)-METHYL]-1,10-PHENANTHROLIN-2-YL)-METHYL]-EPHEDRINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H52N4O
InChI InChI=1S/C37H52N4O/c1-5-6-7-8-9-10-11-12-13-17-26-40(3)27-33-24-22-30-20-21-31-23-25-34(39-36(31)35(30)38-33)28-41(4)29(2)37(42)32-18-15-14-16-19-32/h14-16,18-25,29,37,42H,5-13,17,26-28H2,1-4H3/t29-,37+/m0/s1
InChIKey MYHQZNFFSPMAGJ-LUPQGNFSSA-N
Literature Reference Author J.G.J.WEIJNEN,A.KOUDIJS,J.F.J.ENGBERSEN
Literature Reference Citation J.ORG.CHEM.,57,7258(1992)
Literature Reference DOI 10.1021/jo00052a047
Molecular Weight 568.846 g/mol
Solvent CDCl3
Source File Reference UWCS7316