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(3S,4R,5R)-ETHYL-5-O-(METHYLSULFONYL)-SHIKIMATE
SpectraBase Compound ID 58Ja24ENHba
InChI InChI=1S/C10H16O7S/c1-3-16-10(13)6-4-7(11)9(12)8(5-6)17-18(2,14)15/h4,7-9,11-12H,3,5H2,1-2H3/t7-,8+,9+/m0/s1
InChIKey XRWVWZDGWXYWDC-DJLDLDEBSA-N
Mol Weight 280.29 g/mol
Molecular Formula C10H16O7S
Exact Mass 280.061674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DeOCRIMwCLs
Name (3S,4R,5R)-ETHYL-5-O-(METHYLSULFONYL)-SHIKIMATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H16O7S
InChI InChI=1S/C10H16O7S/c1-3-16-10(13)6-4-7(11)9(12)8(5-6)17-18(2,14)15/h4,7-9,11-12H,3,5H2,1-2H3/t7-,8+,9+/m0/s1
InChIKey XRWVWZDGWXYWDC-DJLDLDEBSA-N
Literature Reference Author N.QUAN,L.D.NIE,R.H.ZHU,X.X.SHI,W.DING,X.LU
Literature Reference Citation EUR.J.ORG.CHEM.,2013,6389(2013)
Literature Reference DOI 10.1002/ejoc.201300804
Molecular Weight 280.293 g/mol
Solvent DMSO-D6
Source File Reference UWBT20004