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(Rs)-5-Benzyloxy-5-hydroxymethyl-2-methoxy-2-(p-toluenesulfinylmethyl)tetrahydropyran
SpectraBase Compound ID G8TY5MMa6Yk
InChI InChI=1S/C22H28O5S/c1-18-8-10-20(11-9-18)28(24)17-22(25-2)13-12-21(15-23,16-27-22)26-14-19-6-4-3-5-7-19/h3-11,23H,12-17H2,1-2H3
InChIKey GLRZUUUEQJECDW-UHFFFAOYSA-N
Mol Weight 404.52 g/mol
Molecular Formula C22H28O5S
Exact Mass 404.165745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3glnF2NJh0S
Name (Rs)-5-Benzyloxy-5-hydroxymethyl-2-methoxy-2-(p-toluenesulfinylmethyl)tetrahydropyran
Comments Less than 3 mono-isotopic peaks
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Formula C22H28O5S
InChI InChI=1S/C22H28O5S/c1-18-8-10-20(11-9-18)28(24)17-22(25-2)13-12-21(15-23,16-27-22)26-14-19-6-4-3-5-7-19/h3-11,23H,12-17H2,1-2H3
InChIKey GLRZUUUEQJECDW-UHFFFAOYSA-N
Molecular Weight 404.521 g/mol
SMILES OCC1(CCC(CS(c2ccc(cc2)C)=O)(OC1)OC)OCc1ccccc1
SPLASH splash10-0006-9000000000-29f1dd220ad6b5e7b315
Source of Spectrum E1-46-220-7
Synonyms (3-(benzyloxy)-6-methoxy-6-{[(4-methylphenyl)sulfinyl]methyl}tetrahydro-2H-pyran-3-yl)methanol
Wiley ID 1554172