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Methyl-4,6-(o-benzylidene)-2-deoxy-2-C-methyl-3-o-methylthiothiocarbonyl-.alpha.-D-altro-pyranoside

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Methyl-4,6-(o-benzylidene)-2-deoxy-2-C-methyl-3-o-methylthiothiocarbonyl-.alpha.-D-altro-pyranoside
SpectraBase Compound ID BSWBJPQRi8H
InChI InChI=1S/C17H22O5S2/c1-10-13(22-17(23)24-3)14-12(20-15(10)18-2)9-19-16(21-14)11-7-5-4-6-8-11/h4-8,10,12-16H,9H2,1-3H3
InChIKey PQMLNTQCUBJVJY-UHFFFAOYSA-N
Mol Weight 370.48 g/mol
Molecular Formula C17H22O5S2
Exact Mass 370.090866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Jep4kAO82x
Name Methyl-4,6-(o-benzylidene)-2-deoxy-2-C-methyl-3-o-methylthiothiocarbonyl-.alpha.-D-altro-pyranoside
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.090866151 u
Formula C17H22O5S2
InChI InChI=1S/C17H22O5S2/c1-10-13(22-17(23)24-3)14-12(20-15(10)18-2)9-19-16(21-14)11-7-5-4-6-8-11/h4-8,10,12-16H,9H2,1-3H3
InChIKey PQMLNTQCUBJVJY-UHFFFAOYSA-N
Molecular Weight 370.478 g/mol
SMILES C12OC(C(C(C2OC(OC1)C1=CC=CC=C1)OC(=S)SC)C)OC