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1-thioglucopyranose, pentaacetate
SpectraBase Compound ID 70IOusAGp6u
InChI InChI=1S/C16H22O10S/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(26-12)27-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16?/m1/s1
InChIKey CFAJEDWNNGFOQV-IWQYDBTJSA-N
Mol Weight 406.4 g/mol
Molecular Formula C16H22O10S
Exact Mass 406.093368 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KFHL7djiXD5
Name (+)-1-THIOGLUCOPYRANOSE, PENTAACETATE
Source of Sample Eastman Organic Chemicals, Rochester, New York
Comments Tentative assignment; Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O10S
InChI InChI=1S/C16H22O10S/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(26-12)27-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16?/m1/s1
InChIKey CFAJEDWNNGFOQV-IWQYDBTJSA-N
Melting Point 118-120C
Molecular Weight 406.41
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms GLUCOSE, 1-THIO-, PENTAACETATE, /plus/-, GLUCOPYRANOSIDE, 1-THIO-, PENTA- ACETATE, /plus/-,