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(2S*,3R*)-2,4-Dimethyl-1-phenylthio-3-pentanol
SpectraBase Compound ID CMnV2v87fte
InChI InChI=1S/C13H20OS/c1-10(2)13(14)11(3)9-15-12-7-5-4-6-8-12/h4-8,10-11,13-14H,9H2,1-3H3/t11-,13-/m1/s1
InChIKey OCYWIOZUNBYICP-DGCLKSJQSA-N
Mol Weight 224.36 g/mol
Molecular Formula C13H20OS
Exact Mass 224.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfrgvUQhA2K
Name (2S*,3R*)-2,4-Dimethyl-1-phenylthio-3-pentanol
Alternate Name(s) (2R*,3S*)-2,4-Dimethyl-1-phenylthio-3-pentanol (2S,3R)-2,4-dimethyl-1-(phenylsulfanyl)-3-pentanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20OS
InChI InChI=1S/C13H20OS/c1-10(2)13(14)11(3)9-15-12-7-5-4-6-8-12/h4-8,10-11,13-14H,9H2,1-3H3/t11-,13-/m1/s1
InChIKey OCYWIOZUNBYICP-DGCLKSJQSA-N
Molecular Weight 224.362 g/mol
SMILES O[C@@]([C@@](CSc1ccccc1)(C)[H])(C(C)C)[H]
SPLASH splash10-0229-9620000000-13b30a21f8e95ef3995c
Source of Spectrum AJ-69-2102-2
Wiley ID 773858