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N-OCTYL-(N-OCTYL-ALPHA-D-MANNOPYRANOSIDURONATE)
SpectraBase Compound ID KrQ9vKs97Zq
InChI InChI=1S/C22H42O7/c1-3-5-7-9-11-13-15-27-21(26)20-18(24)17(23)19(25)22(29-20)28-16-14-12-10-8-6-4-2/h17-20,22-25H,3-16H2,1-2H3/t17-,18-,19-,20-,22-/m0/s1
InChIKey PWMMZIQZBRMQEM-HVAMYJMISA-N
Mol Weight 418.6 g/mol
Molecular Formula C22H42O7
Exact Mass 418.293054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GwKoABw6oUu
Name N-OCTYL-(N-OCTYL-ALPHA-D-MANNOPYRANOSIDURONATE)
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H42O7
InChI InChI=1S/C22H42O7/c1-3-5-7-9-11-13-15-27-21(26)20-18(24)17(23)19(25)22(29-20)28-16-14-12-10-8-6-4-2/h17-20,22-25H,3-16H2,1-2H3/t17-,18-,19-,20-,22-/m0/s1
InChIKey PWMMZIQZBRMQEM-HVAMYJMISA-N
Literature Reference Author M.ROUSSEL,T.BENVEGNU,V.LOGNONE,H.L.DEIT,I.SOUTREL,I.LAURENT, D.PLUSQUELLEC
Literature Reference Citation EUR.J.ORG.CHEM.,3085(2005)
Molecular Weight 418.571 g/mol
Sample ID 29962
Solvent CDCl3