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(+-)-1-[(2'R*,3'S*)-2'-Methylthio-3'-hydroxyhexyl]-2-pyridone
SpectraBase Compound ID 6vKNslH8ggK
InChI InChI=1S/C12H19NO2S/c1-3-6-10(14)11(16-2)9-13-8-5-4-7-12(13)15/h4-5,7-8,10-11,14H,3,6,9H2,1-2H3/t10-,11+/m0/s1
InChIKey VWEUKQGYSVLNCB-WDEREUQCSA-N
Mol Weight 241.35 g/mol
Molecular Formula C12H19NO2S
Exact Mass 241.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5F0DHdIFfLV
Name (+-)-1-[(2'R*,3'S*)-2'-Methylthio-3'-hydroxyhexyl]-2-pyridone
Alternate Name(s) (+-)-1-[(2'R*,3'S*)-2'-Methylthio-3'-hydrohexyl]-2-pyridone 1-[(2R,3S)-3-hydroxy-2-(methylsulfanyl)hexyl]-2(1H)-pyridinone
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Formula C12H19NO2S
InChI InChI=1S/C12H19NO2S/c1-3-6-10(14)11(16-2)9-13-8-5-4-7-12(13)15/h4-5,7-8,10-11,14H,3,6,9H2,1-2H3/t10-,11+/m0/s1
InChIKey VWEUKQGYSVLNCB-WDEREUQCSA-N
Molecular Weight 241.349 g/mol
SMILES O[C@]([C@@](CN1C(C=CC=C1)=O)(SC)[H])(CCC)[H]
SPLASH splash10-0fnd-9400000000-075ed321e73a69884797
Source of Spectrum F-52-3621-2
Wiley ID 795700