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1,2,4,6-Tetra-o-acetyl-3-(acetylamino)-3-deoxyhexopyranose

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1,2,4,6-Tetra-o-acetyl-3-(acetylamino)-3-deoxyhexopyranose
SpectraBase Compound ID EISSyYaZdN2
InChI InChI=1S/C16H23NO10/c1-7(18)17-13-14(24-9(3)20)12(6-23-8(2)19)27-16(26-11(5)22)15(13)25-10(4)21/h12-16H,6H2,1-5H3,(H,17,18)
InChIKey DFTAHEWBJYDOLQ-UHFFFAOYSA-N
Mol Weight 389.36 g/mol
Molecular Formula C16H23NO10
Exact Mass 389.132196 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1mQqOPyMu8k
Name 1,2,4,6-Tetra-o-acetyl-3-(acetylamino)-3-deoxyhexopyranose
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.132195935 u
Formula C16H23NO10
InChI InChI=1S/C16H23NO10/c1-7(18)17-13-14(24-9(3)20)12(6-23-8(2)19)27-16(26-11(5)22)15(13)25-10(4)21/h12-16H,6H2,1-5H3,(H,17,18)
InChIKey DFTAHEWBJYDOLQ-UHFFFAOYSA-N
Molecular Weight 389.357 g/mol
SMILES C1(C(C(OC(C1OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)NC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.984004