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[(2R,3S,4R,5R,6R)-4,5,6-triacetoxy-3-acetylsulfanyl-tetrahydropyran-2-yl]methyl acetate

View entire compound with spectra: 1 MS (GC)

[(2R,3S,4R,5R,6R)-4,5,6-triacetoxy-3-acetylsulfanyl-tetrahydropyran-2-yl]methyl acetate
SpectraBase Compound ID IyARpjFM2O7
InChI InChI=1S/C16H22O10S/c1-7(17)22-6-12-15(27-11(5)21)13(23-8(2)18)14(24-9(3)19)16(26-12)25-10(4)20/h12-16H,6H2,1-5H3/t12-,13-,14-,15+,16+/m1/s1
InChIKey AITRPFYRUORORI-SUJAAXHWSA-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 7BK1oKa1aI
Name [(2R,3S,4R,5R,6R)-4,5,6-triacetoxy-3-acetylsulfanyl-tetrahydropyran-2-yl]methyl acetate
Alternate Name(s) [(2R,3S,4R,5R,6R)-4,5,6-triacetyloxy-3-acetylsulfanyloxan-2-yl]methyl acetate [(2R,3S,4R,5R,6R)-4,5,6-triacetyloxy-3-ethanoylsulfanyl-oxan-2-yl]methyl ethanoate Acetic acid [(2R,3S,4R,5R,6R)-4,5,6-triacetyloxy-3-(acetylthio)-2-oxanyl]methyl ester
CAS Registry Number 118918-81-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O10S
InChI InChI=1S/C16H22O10S/c1-7(17)22-6-12-15(27-11(5)21)13(23-8(2)18)14(24-9(3)19)16(26-12)25-10(4)20/h12-16H,6H2,1-5H3/t12-,13-,14-,15+,16+/m1/s1
InChIKey AITRPFYRUORORI-SUJAAXHWSA-N
Molecular Weight 406.402 g/mol
SMILES [C@@]1([C@]([C@@](SC(=O)C)([C@](O[C@@]1(OC(=O)C)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-6790000000-aa5ff68acba9e23af6e2
Source of Spectrum J-54-1889-12
Wiley ID 1371936