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2,6-BIS-[(N-[5-(MESYLOXY)-3-OXAPENTYL]-N-TOSYLAMINO)-METHYL]-PYRIDINE
SpectraBase Compound ID 9pvy4pdEwUc
InChI InChI=1S/C31H43N3O12S4/c1-26-8-12-30(13-9-26)49(39,40)33(16-18-43-20-22-45-47(3,35)36)24-28-6-5-7-29(32-28)25-34(17-19-44-21-23-46-48(4,37)38)50(41,42)31-14-10-27(2)11-15-31/h5-15H,16-25H2,1-4H3
InChIKey VNSSPGOUORYJEM-UHFFFAOYSA-N
Mol Weight 777.9 g/mol
Molecular Formula C31H43N3O12S4
Exact Mass 777.172959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9yFz7sq4sG
Name 2,6-BIS-[(N-[5-(MESYLOXY)-3-OXAPENTYL]-N-TOSYLAMINO)-METHYL]-PYRIDINE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H43N3O12S4
InChI InChI=1S/C31H43N3O12S4/c1-26-8-12-30(13-9-26)49(39,40)33(16-18-43-20-22-45-47(3,35)36)24-28-6-5-7-29(32-28)25-34(17-19-44-21-23-46-48(4,37)38)50(41,42)31-14-10-27(2)11-15-31/h5-15H,16-25H2,1-4H3
InChIKey VNSSPGOUORYJEM-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 777.935 g/mol
Solvent CDCl3
Source File Reference UWCS12572