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METHYL-6-DEOXY-6-ISOTHIOCYANATO-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID IpxsfdTimwx
InChI InChI=1S/C8H13NO5S/c1-13-8-7(12)6(11)5(10)4(14-8)2-9-3-15/h4-8,10-12H,2H2,1H3/t4-,5-,6+,7-,8-/m1/s1
InChIKey KYVRRJZVALRRBA-JAJWTYFOSA-N
Mol Weight 235.25 g/mol
Molecular Formula C8H13NO5S
Exact Mass 235.051444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G5LgH30G0hA
Name METHYL-6-DEOXY-6-ISOTHIOCYANATO-BETA-D-GLUCOPYRANOSIDE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H13NO5S
InChI InChI=1S/C8H13NO5S/c1-13-8-7(12)6(11)5(10)4(14-8)2-9-3-15/h4-8,10-12H,2H2,1H3/t4-,5-,6+,7-,8-/m1/s1
InChIKey KYVRRJZVALRRBA-JAJWTYFOSA-N
Literature Reference Author J.M.G.FERNANDEZ,C.O.MELLET,J.FUENTES
Literature Reference Citation J.ORG.CHEM.,58,5192(1993)
Literature Reference DOI 10.1021/jo00071a032
Molecular Weight 235.255 g/mol
Solvent ACETONE-D6
Source File Reference UWGE5263