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2-(BETA-D-GLUCOPYRANOSYL)-ETHYL_METHANETHIOSULFONATE
SpectraBase Compound ID 6jtB7rpokCb
InChI InChI=1S/C9H18O8S2/c1-19(14,15)18-3-2-16-9-8(13)7(12)6(11)5(4-10)17-9/h5-13H,2-4H2,1H3/t5-,6-,7+,8-,9-/m0/s1
InChIKey NUVZIEFUROVDGZ-PQFOHKHZSA-N
Mol Weight 318.36 g/mol
Molecular Formula C9H18O8S2
Exact Mass 318.04431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3CQw8zJclyE
Name 2-(BETA-D-GLUCOPYRANOSYL)-ETHYL_METHANETHIOSULFONATE
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H18O8S2
InChI InChI=1S/C9H18O8S2/c1-19(14,15)18-3-2-16-9-8(13)7(12)6(11)5(4-10)17-9/h5-13H,2-4H2,1H3/t5-,6-,7+,8-,9-/m0/s1
InChIKey NUVZIEFUROVDGZ-PQFOHKHZSA-N
Literature Reference Author B.G.DAVIS,R.C.LLOYD,J.B.JONES
Literature Reference Citation J.ORG.CHEM.,63,9614(1998)
Literature Reference DOI 10.1021/jo9816461
Molecular Weight 318.357 g/mol
Sample ID 26676
Solvent D2O