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(2S,3S)-3-methyl-2-(4-methylphenyl)sulfonyloxypentanoic acid methyl ester
SpectraBase Compound ID JQLuiJVxeLx
InChI InChI=1S/C14H20O5S/c1-5-11(3)13(14(15)18-4)19-20(16,17)12-8-6-10(2)7-9-12/h6-9,11,13H,5H2,1-4H3/t11-,13-/m0/s1
InChIKey RNLKQPJJHATCON-AAEUAGOBSA-N
Mol Weight 300.37 g/mol
Molecular Formula C14H20O5S
Exact Mass 300.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KlcB5dLf6
Name (2S,3S)-3-methyl-2-(4-methylphenyl)sulfonyloxypentanoic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O5S
InChI InChI=1S/C14H20O5S/c1-5-11(3)13(14(15)18-4)19-20(16,17)12-8-6-10(2)7-9-12/h6-9,11,13H,5H2,1-4H3/t11-,13-/m0/s1
InChIKey RNLKQPJJHATCON-AAEUAGOBSA-N
Molecular Weight 300.369 g/mol
SMILES [C@](OS(c1ccc(cc1)C)(=O)=O)(C(=O)OC)([C@](CC)(C)[H])[H]
SPLASH splash10-052f-9700000000-b1c7a2f5f81ea274dbe3
Source of Spectrum KC-0-1971-6
Synonyms (2S,3S)-3-methyl-2-tosyloxy-valeric acid methyl ester methyl (2S,3S)-3-methyl-2-(p-tolylsulfonyloxy)pentanoate methyl (2S,3S)-3-methyl-2-(4-methylphenyl)sulfonyloxypentanoate
Wiley ID 781705