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Methyl-4,6-O-benzylidene-3-tosyl-A-D-allopyranoside
SpectraBase Compound ID El30a0UjE7x
InChI InChI=1S/C21H24O8S/c1-13-8-10-15(11-9-13)30(23,24)29-19-17(22)18-16(27-21(19)25-2)12-26-20(28-18)14-6-4-3-5-7-14/h3-11,16-22H,12H2,1-2H3
InChIKey BBWKTKLCLZHSJW-UHFFFAOYSA-N
Mol Weight 436.48 g/mol
Molecular Formula C21H24O8S
Exact Mass 436.119189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HchNtGd1K5u
Name alpha-D-ALLOPYRANOSIDE, METHYL 4,6-O-(PHENYLMETHYLENE)-, 2-(4-METHYLBENZENESULFONATE)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H24O8S
InChI InChI=1S/C21H24O8S/c1-13-8-10-15(11-9-13)30(23,24)29-19-17(22)18-16(27-21(19)25-2)12-26-20(28-18)14-6-4-3-5-7-14/h3-11,16-22H,12H2,1-2H3
InChIKey BBWKTKLCLZHSJW-UHFFFAOYSA-N
Molecular Weight 436.1185
SMILES OC1C2OC(c3ccccc3)OCC2OC(OC)C1OS(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0a4i-9720000000-9e95da3359288d8aa314
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany