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4-OCTYL-10-(4'-METHYLBENZENESULFONYL)-4,10-DIAZA-1,7-DIOXACYCLODECANE
SpectraBase Compound ID LCzYOPeKHss
InChI InChI=1S/C23H40N2O4S/c1-3-4-5-6-7-8-13-24-14-18-28-20-16-25(17-21-29-19-15-24)30(26,27)23-11-9-22(2)10-12-23/h9-12H,3-8,13-21H2,1-2H3
InChIKey JVSJPKWLGDAMFP-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C23H40N2O4S
Exact Mass 440.270879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2kQbPa6911w
Name 4-OCTYL-10-(4'-METHYLBENZENESULFONYL)-4,10-DIAZA-1,7-DIOXACYCLODECANE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H40N2O4S
InChI InChI=1S/C23H40N2O4S/c1-3-4-5-6-7-8-13-24-14-18-28-20-16-25(17-21-29-19-15-24)30(26,27)23-11-9-22(2)10-12-23/h9-12H,3-8,13-21H2,1-2H3
InChIKey JVSJPKWLGDAMFP-UHFFFAOYSA-N
Literature Reference Author L.ECHEGOYEN,R.C.LAWSON,C.LOPEZ,J.DEMENDOZA,Y.HAFEZ,T.TORRES
Literature Reference Citation J.ORG.CHEM.,59,3814(1994)
Literature Reference DOI 10.1021/jo00093a013
Molecular Weight 440.642 g/mol
Solvent CDCl3
Source File Reference UWCP2841