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1,11-BIS-[6-(HYDROXYMETHYL)-PYRIDIN-2-YL]-2,6,10-TRITOSYL-2,6,10-TRIAZA-UNDECANE

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1,11-BIS-[6-(HYDROXYMETHYL)-PYRIDIN-2-YL]-2,6,10-TRITOSYL-2,6,10-TRIAZA-UNDECANE
SpectraBase Compound ID LustSrEs1Go
InChI InChI=1S/C41H49N5O8S3/c1-32-12-18-39(19-13-32)55(49,50)44(24-6-26-45(28-35-8-4-10-37(30-47)42-35)56(51,52)40-20-14-33(2)15-21-40)25-7-27-46(29-36-9-5-11-38(31-48)43-36)57(53,54)41-22-16-34(3)17-23-41/h4-5,8-23,47-48H,6-7,24-31H2,1-3H3
InChIKey SYUQYFMIGPEZBL-UHFFFAOYSA-N
Mol Weight 836.0 g/mol
Molecular Formula C41H49N5O8S3
Exact Mass 835.274327 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6CP7RGokzlu
Name 1,11-BIS-[6-(HYDROXYMETHYL)-PYRIDIN-2-YL]-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 C41H49N5O8S3
InChI InChI=1S/C41H49N5O8S3/c1-32-12-18-39(19-13-32)55(49,50)44(24-6-26-45(28-35-8-4-10-37(30-47)42-35)56(51,52)40-20-14-33(2)15-21-40)25-7-27-46(29-36-9-5-11-38(31-48)43-36)57(53,54)41-22-16-34(3)17-23-41/h4-5,8-23,47-48H,6-7,24-31H2,1-3H3
InChIKey SYUQYFMIGPEZBL-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 836.049 g/mol
Solvent CDCl3
Source File Reference UWCS12581