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N-Acetyl-1-o-benzyl-3,4,6-o-trimethylglucosamine

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N-Acetyl-1-o-benzyl-3,4,6-o-trimethylglucosamine
SpectraBase Compound ID Ku6kdUyHxBl
InChI InChI=1S/C18H27NO6/c1-12(20)19-15-17(23-4)16(22-3)14(11-21-2)25-18(15)24-10-13-8-6-5-7-9-13/h5-9,14-18H,10-11H2,1-4H3,(H,19,20)/t14-,15-,16-,17-,18+/m1/s1
InChIKey BBGPAFZDLPWICP-ZKXLYKBJSA-N
Mol Weight 353.42 g/mol
Molecular Formula C18H27NO6
Exact Mass 353.183838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SpRyXjO36Y
Name N-Acetyl-1-o-benzyl-3,4,6-o-trimethylglucosamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.183837587 u
Formula C18H27NO6
InChI InChI=1S/C18H27NO6/c1-12(20)19-15-17(23-4)16(22-3)14(11-21-2)25-18(15)24-10-13-8-6-5-7-9-13/h5-9,14-18H,10-11H2,1-4H3,(H,19,20)/t14-,15-,16-,17-,18+/m1/s1
InChIKey BBGPAFZDLPWICP-ZKXLYKBJSA-N
Molecular Weight 353.415 g/mol
SMILES [C@@]1([C@](O[C@@]([C@@]([C@]1(OC)[H])(NC(C)=O)[H])(OCC=1C=CC=CC1)[H])(COC)[H])(OC)[H]