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(1R,3R)-1-[4-(Phenylsulfanyl)tetrahydropyran-4-yl]butane-1,3,4-triol
SpectraBase Compound ID 78v9Dh3xmLB
InChI InChI=1S/C15H22O4S/c16-11-12(17)10-14(18)15(6-8-19-9-7-15)20-13-4-2-1-3-5-13/h1-5,12,14,16-18H,6-11H2/t12-,14-/m1/s1
InChIKey XIYDWDGJQVYOJL-TZMCWYRMSA-N
Mol Weight 298.4 g/mol
Molecular Formula C15H22O4S
Exact Mass 298.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1tXRsEcma6
Name (1R,3R)-1-[4-(Phenylsulfanyl)tetrahydropyran-4-yl]butane-1,3,4-triol
Alternate Name(s) (2R,4R)-4-[4-(phenylsulfanyl)tetrahydro-2H-pyran-4-yl]-1,2,4-butanetriol (2R,4R)-4-[4-(phenylthio)-4-oxanyl]butane-1,2,4-triol (2R,4R)-4-(4-phenylsulfanyltetrahydropyran-4-yl)butane-1,2,4-triol (2R,4R)-4-(4-phenylsulfanyloxan-4-yl)butane-1,2,4-triol
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Formula C15H22O4S
InChI InChI=1S/C15H22O4S/c16-11-12(17)10-14(18)15(6-8-19-9-7-15)20-13-4-2-1-3-5-13/h1-5,12,14,16-18H,6-11H2/t12-,14-/m1/s1
InChIKey XIYDWDGJQVYOJL-TZMCWYRMSA-N
Molecular Weight 298.397 g/mol
SMILES O[C@@](CO)(C[C@](C1(Sc2ccccc2)CCOCC1)(O)[H])[H]
SPLASH splash10-0udr-0920000000-41f4954b422a9bc4712d
Source of Spectrum K-2002-2639-7
Wiley ID 1613266