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N,N-DIHEXANOL-1-(BETA-D-GLUCOPYRANOSYL)-1,2,3-TRIAZOLE-4,5-DICARBOXAMIDE
SpectraBase Compound ID I8hh6OnNK0B
InChI InChI=1S/C22H39N5O9/c28-11-7-3-1-5-9-23-20(34)15-16(21(35)24-10-6-2-4-8-12-29)27(26-25-15)22-19(33)18(32)17(31)14(13-30)36-22/h14,17-19,22,28-33H,1-13H2,(H,23,34)(H,24,35)/t14-,17-,18+,19-,22-/m0/s1
InChIKey LSXJVACLBGFKSI-FQDUKEJRSA-N
Mol Weight 517.6 g/mol
Molecular Formula C22H39N5O9
Exact Mass 517.274778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JZlyEyqPqbF
Name N,N-DIHEXANOL-1-(BETA-D-GLUCOPYRANOSYL)-1,2,3-TRIAZOLE-4,5-DICARBOXAMIDE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H39N5O9
InChI InChI=1S/C22H39N5O9/c28-11-7-3-1-5-9-23-20(34)15-16(21(35)24-10-6-2-4-8-12-29)27(26-25-15)22-19(33)18(32)17(31)14(13-30)36-22/h14,17-19,22,28-33H,1-13H2,(H,23,34)(H,24,35)/t14-,17-,18+,19-,22-/m0/s1
InChIKey LSXJVACLBGFKSI-FQDUKEJRSA-N
Literature Reference Author Y.A.AL-SOUD,N.A.AL-MASOUDI
Literature Reference Citation SPECTROSC.LETT.,36,461(2003)
Literature Reference DOI 10.1081/sl-120026612
Molecular Weight 517.580 g/mol
Sample ID 968976
Solvent C5D5N