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5-O-Acetyl-1,2-O-isopropylidene-3-O-methylsulphonyl-4a-carba-.alpha.-DL-xylofuranose
SpectraBase Compound ID ERqHxckS5Mg
InChI InChI=1S/C12H20O7S/c1-7(13)16-6-8-5-9-11(18-12(2,3)17-9)10(8)19-20(4,14)15/h8-11H,5-6H2,1-4H3
InChIKey RFDMYMCWBXRYSX-UHFFFAOYSA-N
Mol Weight 308.35 g/mol
Molecular Formula C12H20O7S
Exact Mass 308.092974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EZI3Hj1Qm9
Name 5-O-Acetyl-1,2-O-isopropylidene-3-O-methylsulphonyl-4a-carba-.alpha.-DL-xylofuranose
Alternate Name(s) {(3aS,4S,5R,6aS)-2,2-dimethyl-4-[(methylsulfonyl)oxy]tetrahydro-3aH-cyclopenta[d][1,3]dioxol-5-yl}methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O7S
InChI InChI=1S/C12H20O7S/c1-7(13)16-6-8-5-9-11(18-12(2,3)17-9)10(8)19-20(4,14)15/h8-11H,5-6H2,1-4H3
InChIKey RFDMYMCWBXRYSX-UHFFFAOYSA-N
Molecular Weight 308.345 g/mol
SMILES C12C(C(COC(=O)C)CC2OC(O1)(C)C)OS(=O)(=O)C
SPLASH splash10-0006-9220000000-240b3602f919aed4e067
Source of Spectrum F-54-11051-9
Wiley ID 808796