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N-[6-(4-ISOPROPYLBENZOYLAMINO)-HEXYL]-1,5-DIDEOXY-1,5-IMINO-D-GALACTITOL
SpectraBase Compound ID 9EBPYDpESAz
InChI InChI=1S/C22H36N2O5/c1-15(2)16-7-9-17(10-8-16)22(29)23-11-5-3-4-6-12-24-13-19(26)21(28)20(27)18(24)14-25/h7-10,15,18-21,25-28H,3-6,11-14H2,1-2H3,(H,23,29)/t18-,19+,20+,21-/m0/s1
InChIKey QXNMZRYWKAHPFM-BQJUDKOJSA-N
Mol Weight 408.5 g/mol
Molecular Formula C22H36N2O5
Exact Mass 408.262422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LM2aJr9hjSJ
Name N-[6-(4-ISOPROPYLBENZOYLAMINO)-HEXYL]-1,5-DIDEOXY-1,5-IMINO-D-GALACTITOL
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36N2O5
InChI InChI=1S/C22H36N2O5/c1-15(2)16-7-9-17(10-8-16)22(29)23-11-5-3-4-6-12-24-13-19(26)21(28)20(27)18(24)14-25/h7-10,15,18-21,25-28H,3-6,11-14H2,1-2H3,(H,23,29)/t18-,19+,20+,21-/m0/s1
InChIKey QXNMZRYWKAHPFM-BQJUDKOJSA-N
Literature Reference Author G.SCHITTER,E.SCHEUCHER,A.J.STEINER,A.E.STUETZ,M.THONHOFER,C. A.TARLING,S.G.WITHER
Literature Reference Citation BEIL.J.ORG.CHEM.,6,21,1(2010)
Molecular Weight 408.538 g/mol
Solvent CD3OD:CDCl3=2:1
Source File Reference UWBT10003