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(2S,3S)-2-Methyl-1-(4-methylbenzenesulfonyloxy)-3-pentanol
SpectraBase Compound ID A7a4UAcc7j2
InChI InChI=1S/C13H20O4S/c1-4-13(14)11(3)9-17-18(15,16)12-7-5-10(2)6-8-12/h5-8,11,13-14H,4,9H2,1-3H3/t11-,13-/m0/s1
InChIKey FNFGDIDPVOXZBW-AAEUAGOBSA-N
Mol Weight 272.36 g/mol
Molecular Formula C13H20O4S
Exact Mass 272.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hb8c7bLtrLs
Name (2S,3S)-2-Methyl-1-(4-methylbenzenesulfonyloxy)-3-pentanol
Alternate Name(s) 4-Methylbenzenesulfonic acid[(2S,3S)-3-hydroxy-2-methyl-pentyl]ester [(2S,3S)-2-methyl-3-oxidanyl-pentyl]4-methylbenzenesulfonate [(2S,3S)-3-hydroxy-2-methyl-pentyl]4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid [(2S,3S)-3-hydroxy-2-methylpentyl] ester [(2S,3S)-3-hydroxy-2-methylpentyl] 4-methylbenzenesulfonate [(2S,3S)-3-hydroxy-2-methyl-pentyl] 4-methylbenzenesulfonate [(2S,3S)-2-methyl-3-oxidanyl-pentyl] 4-methylbenzenesulfonate
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Formula C13H20O4S
InChI InChI=1S/C13H20O4S/c1-4-13(14)11(3)9-17-18(15,16)12-7-5-10(2)6-8-12/h5-8,11,13-14H,4,9H2,1-3H3/t11-,13-/m0/s1
InChIKey FNFGDIDPVOXZBW-AAEUAGOBSA-N
Molecular Weight 272.359 g/mol
SMILES O[C@]([C@](COS(c1ccc(cc1)C)(=O)=O)(C)[H])(CC)[H]
SPLASH splash10-008c-9610000000-22525db32b1e895c3699
Source of Spectrum F-50-2710-9
Wiley ID 1275872