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(+)-[4S,5S,S(R)]-4-Methyl-5-(p-tolylsulfinyl)methyl]dihydrofuran-2-one
SpectraBase Compound ID 3zBlTagJsc4
InChI InChI=1S/C13H16O3S/c1-9-3-5-11(6-4-9)17(15)8-12-10(2)7-13(14)16-12/h3-6,10,12H,7-8H2,1-2H3/t10-,12+,17?/m0/s1
InChIKey VOSIZXUACUMVDG-FKBVNXBNSA-N
Mol Weight 252.33 g/mol
Molecular Formula C13H16O3S
Exact Mass 252.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH1NjQNf3Vl
Name (+)-[4S,5S,S(R)]-4-Methyl-5-(p-tolylsulfinyl)methyl]dihydrofuran-2-one
Alternate Name(s) (4S,5S)-4-methyl-5-[[(R)-(4-methylphenyl)sulfinyl]methyl]-2-oxolanone (4S,5S)-4-methyl-5-[[(R)-(4-methylphenyl)sulfinyl]methyl]oxolan-2-one
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Formula C13H16O3S
InChI InChI=1S/C13H16O3S/c1-9-3-5-11(6-4-9)17(15)8-12-10(2)7-13(14)16-12/h3-6,10,12H,7-8H2,1-2H3/t10-,12+,17?/m0/s1
InChIKey VOSIZXUACUMVDG-FKBVNXBNSA-N
Molecular Weight 252.328 g/mol
SMILES C([S@](c1ccc(cc1)C)=O)[C@]1(OC(=O)C[C@@]1(C)[H])[H]
SPLASH splash10-0006-9610000000-c185dd119ef43f8eca95
Source of Spectrum F-70-10043-14
Wiley ID 1598024