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[(4-nitrobenzyl)thio]methanethioic acid O-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl]methyl] ester
SpectraBase Compound ID FOhAldPkq4Y
InChI InChI=1S/C15H19NO8S2/c1-22-14-13(19)12(18)11(17)10(24-14)6-23-15(25)26-7-8-2-4-9(5-3-8)16(20)21/h2-5,10-14,17-19H,6-7H2,1H3/t10-,11-,12+,13-,14+/m1/s1
InChIKey QGIKTRXNXISOSU-RGDJUOJXSA-N
Mol Weight 405.44 g/mol
Molecular Formula C15H19NO8S2
Exact Mass 405.055209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7YWW2YQAcEc
Name [(4-nitrobenzyl)thio]methanethioic acid O-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl]methyl] ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H19NO8S2
InChI InChI=1S/C15H19NO8S2/c1-22-14-13(19)12(18)11(17)10(24-14)6-23-15(25)26-7-8-2-4-9(5-3-8)16(20)21/h2-5,10-14,17-19H,6-7H2,1H3/t10-,11-,12+,13-,14+/m1/s1
InChIKey QGIKTRXNXISOSU-RGDJUOJXSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 405.438 g/mol
Source File Reference MHKO3249