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(2S,5R)-2-(methoxymethoxymethyl)-5-methyl-2-[[(R)-(4-methylphenyl)sulfinyl]methyl]oxane
SpectraBase Compound ID FlkiP7TUi7B
InChI InChI=1S/C17H26O4S/c1-14-4-6-16(7-5-14)22(18)12-17(11-20-13-19-3)9-8-15(2)10-21-17/h4-7,15H,8-13H2,1-3H3/t15-,17+,22?/m1/s1
InChIKey PXYGCINILQUZMN-QQROTITISA-N
Mol Weight 326.45 g/mol
Molecular Formula C17H26O4S
Exact Mass 326.15518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hbRbPs6FLi
Name (2S,5R)-2-(methoxymethoxymethyl)-5-methyl-2-[[(R)-(4-methylphenyl)sulfinyl]methyl]oxane
Alternate Name(s) (2S,5R)-2-(methoxymethoxymethyl)-5-methyl-2-[[(R)-p-tolylsulfinyl]methyl]tetrahydropyran
Comments Less than 3 mono-isotopic peaks
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Formula C17H26O4S
InChI InChI=1S/C17H26O4S/c1-14-4-6-16(7-5-14)22(18)12-17(11-20-13-19-3)9-8-15(2)10-21-17/h4-7,15H,8-13H2,1-3H3/t15-,17+,22?/m1/s1
InChIKey PXYGCINILQUZMN-QQROTITISA-N
Molecular Weight 326.451 g/mol
SMILES C([S@](c1ccc(cc1)C)=O)[C@@]1(OC[C@@](CC1)(C)[H])COCOC
SPLASH splash10-03di-0900000000-fbc163307c6109ee6858
Source of Spectrum F-54-13100-11
Wiley ID 809425