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2,3,4,6-tetra-O-Acetyl-1,5-anhydro-1-deoxy-1-C-heptyl-.alpha.-D-glucopyranose
SpectraBase Compound ID I1ePKRTAKm
InChI InChI=1S/C21H34O9/c1-6-7-8-9-10-11-17-19(27-14(3)23)21(29-16(5)25)20(28-15(4)24)18(30-17)12-26-13(2)22/h17-21H,6-12H2,1-5H3/t17-,18-,19+,20-,21-/m1/s1
InChIKey ZUZGGQCIGAPUMY-YMQHIKHWSA-N
Mol Weight 430.5 g/mol
Molecular Formula C21H34O9
Exact Mass 430.220283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjavmeV5FUU
Name 2,3,4,6-tetra-O-Acetyl-1,5-anhydro-1-deoxy-1-C-heptyl-.alpha.-D-glucopyranose
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O9
InChI InChI=1S/C21H34O9/c1-6-7-8-9-10-11-17-19(27-14(3)23)21(29-16(5)25)20(28-15(4)24)18(30-17)12-26-13(2)22/h17-21H,6-12H2,1-5H3/t17-,18-,19+,20-,21-/m1/s1
InChIKey ZUZGGQCIGAPUMY-YMQHIKHWSA-N
Molecular Weight 430.494 g/mol
SMILES [C@]1([C@@]([C@@](COC(=O)C)(O[C@@]([C@@]1(OC(=O)C)[H])(CCCCCCC)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-00kg-8940000000-7514eabd41fc7c45fa69
Source of Spectrum U-1996-60-16
Synonyms (1R)-2,3,4,6-tetra-O-acetyl-1,5-anhydro-1-heptyl-D-glucitol
Wiley ID 767931