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1-OCTADECYL-4,7,10-TETRAAZACYCLODODECANE

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1-OCTADECYL-4,7,10-TETRAAZACYCLODODECANE
SpectraBase Compound ID Bq7ENXuAOCD
InChI InChI=1S/C26H56N4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-30-25-22-28-20-18-27-19-21-29-23-26-30/h27-29H,2-26H2,1H3
InChIKey MKHHBCXXHKEZNW-UHFFFAOYSA-N
Mol Weight 424.8 g/mol
Molecular Formula C26H56N4
Exact Mass 424.450498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LclAWyLcFmq
Name 1-OCTADECYL-4,7,10-TETRAAZACYCLODODECANE
Compound Number 7K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H56N4
InChI InChI=1S/C26H56N4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-30-25-22-28-20-18-27-19-21-29-23-26-30/h27-29H,2-26H2,1H3
InChIKey MKHHBCXXHKEZNW-UHFFFAOYSA-N
Literature Reference Author W.C.BAKER,M.J.CHOI,D.C.HILL,J.L.THOMPSON,P.A.PETILLO
Literature Reference Citation J.ORG.CHEM.,64,2683(1999)
Literature Reference DOI 10.1021/jo981920r
Molecular Weight 424.757 g/mol
Sample ID 58569
Solvent CDCl3