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1,6-ANHYDRO-4-DEOXY-3,4-DIMETHYL-2-O-PARA-TOLYLSULFONYL-BETA-D-TALOPYRANOSE
SpectraBase Compound ID E8gnGMdJ5Er
InChI InChI=1S/C15H20O6S/c1-9-4-6-11(7-5-9)22(17,18)21-13-14-19-8-12(20-14)10(2)15(13,3)16/h4-7,10,12-14,16H,8H2,1-3H3/t10-,12+,13+,14+,15-/m0/s1
InChIKey CVLLHUPTNKAFDW-NBRWMIFNSA-N
Mol Weight 328.38 g/mol
Molecular Formula C15H20O6S
Exact Mass 328.09806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YSrUmrUVIp
Name 1,6-Anhydro-4-deoxy-3,4-dimethyl-2-[O-(p-tolylsulfonyl)]-.beta.-D-talopyranose
Alternate Name(s) [(1S,2S,3S,4S,5R)-3-hydroxy-2,3-dimethyl-6,8-dioxabicyclo[3.2.1]octan-4-yl] 4-methylbenzenesulfonate [(1S,2S,3S,4S,5R)-2,3-dimethyl-3-oxidanyl-6,8-dioxabicyclo[3.2.1]octan-4-yl] 4-methylbenzenesulfonate
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Formula C15H20O6S
InChI InChI=1S/C15H20O6S/c1-9-4-6-11(7-5-9)22(17,18)21-13-14-19-8-12(20-14)10(2)15(13,3)16/h4-7,10,12-14,16H,8H2,1-3H3/t10-,12+,13+,14+,15-/m0/s1
InChIKey CVLLHUPTNKAFDW-NBRWMIFNSA-N
Molecular Weight 328.379 g/mol
SMILES O[C@@]1([C@](OS(c2ccc(cc2)C)(=O)=O)([C@]2(O[C@](CO2)([C@@]1(C)[H])[H])[H])[H])C
SPLASH splash10-0a4l-9800000000-5d0ab00ada720f696820
Source of Spectrum H-2005-4562-18
Wiley ID 1587868