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1-Sulfyl-pentacetyl-b-glucose
SpectraBase Compound ID 6kITRPq5FF2
InChI InChI=1S/C16H22O10S/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(26-12)27-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16+/m0/s1
InChIKey CFAJEDWNNGFOQV-ARKGTOAJSA-N
Mol Weight 406.4 g/mol
Molecular Formula C16H22O10S
Exact Mass 406.093368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EB1xnQPx0Qw
Name 1-Sulfyl-pentacetyl-b-glucose
Alternate Name(s) 2,3,4,6-tetra-O-acetyl-1-S-acetyl-1-thio-.beta.-L-glucopyranose
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O10S
InChI InChI=1S/C16H22O10S/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(26-12)27-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16+/m0/s1
InChIKey CFAJEDWNNGFOQV-ARKGTOAJSA-N
Molecular Weight 406.402 g/mol
SMILES [C@]1([C@@]([C@@](OC(=O)C)([C@@](O[C@@]1(SC(=O)C)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9400000000-9cf7956c7f57d663ee3b
Source of Spectrum EP-5679-0-0
Wiley ID 1371933