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1,11-BIS-[(6-[(MESYLOXY)-METHYL]-PYRIDIN-2-YL)-METHYL]-2,6,10-TRITOSYL-2,6,10-TRIAZA-UNDECANE
SpectraBase Compound ID AdKQGZm8pYc
InChI InChI=1S/C43H53N5O12S5/c1-34-14-20-41(21-15-34)63(53,54)46(26-8-28-47(64(55,56)42-22-16-35(2)17-23-42)30-37-10-6-12-39(44-37)32-59-61(4,49)50)27-9-29-48(65(57,58)43-24-18-36(3)19-25-43)31-38-11-7-13-40(45-38)33-60-62(5,51)52/h6-7,10-25H,8-9,26-33H2,1-5H3
InChIKey GTFPMROKWOTGGF-UHFFFAOYSA-N
Mol Weight 992.2 g/mol
Molecular Formula C43H53N5O12S5
Exact Mass 991.229428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45DFawgQWts
Name 1,11-BIS-[(6-[(MESYLOXY)-METHYL]-PYRIDIN-2-YL)-METHYL]-2,6,10-TRITOSYL-2,6,10-TRIAZA-UNDECANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H53N5O12S5
InChI InChI=1S/C43H53N5O12S5/c1-34-14-20-41(21-15-34)63(53,54)46(26-8-28-47(64(55,56)42-22-16-35(2)17-23-42)30-37-10-6-12-39(44-37)32-59-61(4,49)50)27-9-29-48(65(57,58)43-24-18-36(3)19-25-43)31-38-11-7-13-40(45-38)33-60-62(5,51)52/h6-7,10-25H,8-9,26-33H2,1-5H3
InChIKey GTFPMROKWOTGGF-UHFFFAOYSA-N
Literature Reference Author M.W.HOSSEINI,J.COMARMOND,J.M.LEHN
Literature Reference Citation HELV.CHIM.ACTA,72,1066(1989)
Literature Reference DOI 10.1002/hlca.19890720525
Molecular Weight 992.220 g/mol
Solvent CDCl3
Source File Reference UWCS12582