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3-(14-HYDROXYTETRADECYL)-1-[11-(1-OXIDOPYRIDIN-3-YL)-UNDECYL]-PYRIDINIUM-IODIDE
SpectraBase Compound ID Ku7eXSlA0Hh
InChI InChI=1S/C35H59N2O2.HI/c38-31-21-17-13-9-4-2-1-3-6-10-14-18-24-34-26-22-29-36(32-34)28-20-16-12-8-5-7-11-15-19-25-35-27-23-30-37(39)33-35;/h22-23,26-27,29-30,32-33,38H,1-21,24-25,28,31H2;1H/q+1;/p-1
InChIKey QUYBNFIAORVJEQ-UHFFFAOYSA-M
Mol Weight 666.8 g/mol
Molecular Formula C35H59IN2O2
Exact Mass 666.362124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EpIS37Scfn5
Name 3-(14-HYDROXYTETRADECYL)-1-[11-(1-OXIDOPYRIDIN-3-YL)-UNDECYL]-PYRIDINIUM-IODIDE
Compound Number 15J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H59IN2O2
InChI InChI=1S/C35H59N2O2.HI/c38-31-21-17-13-9-4-2-1-3-6-10-14-18-24-34-26-22-29-36(32-34)28-20-16-12-8-5-7-11-15-19-25-35-27-23-30-37(39)33-35;/h22-23,26-27,29-30,32-33,38H,1-21,24-25,28,31H2;1H/q+1;/p-1
InChIKey QUYBNFIAORVJEQ-UHFFFAOYSA-M
Literature Reference Author A.GRUBE,C.TIMM,M.KOUCK
Literature Reference Citation EUR.J.ORG.CHEM.,1285(2006)
Molecular Weight 666.770 g/mol
Sample ID 43394
Solvent DMSO-D6