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Diisopropyl (3' S / 3' R)-2-[3'-hydroxy-2'-(methylsulfanyl)-3',6'-dihydro-2H-thiapyranyl]-phosphonate
SpectraBase Compound ID GdNReKh5Ns7
InChI InChI=1S/C12H23O4PS2/c1-9(2)15-17(14,16-10(3)4)12(18-5)11(13)7-6-8-19-12/h6-7,9-11,13H,8H2,1-5H3/t11-,12-/m0/s1
InChIKey MDBJKLZQVUGVEA-RYUDHWBXSA-N
Mol Weight 326.41 g/mol
Molecular Formula C12H23O4PS2
Exact Mass 326.077539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EpGjl20Q82
Name Diisopropyl (3' S / 3' R)-2-[3'-hydroxy-2'-(methylsulfanyl)-3',6'-dihydro-2H-thiapyranyl]-phosphonate
Alternate Name(s) (5S,6S)-6-di(propan-2-yloxy)phosphoryl-6-(methylthio)-2,5-dihydrothiopyran-5-ol (5S,6S)-6-diisopropoxyphosphoryl-6-methylsulfanyl-2,5-dihydrothiopyran-5-ol (5S,6S)-6-di(propan-2-yloxy)phosphoryl-6-methylsulfanyl-2,5-dihydrothiopyran-5-ol
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Formula C12H23O4PS2
InChI InChI=1S/C12H23O4PS2/c1-9(2)15-17(14,16-10(3)4)12(18-5)11(13)7-6-8-19-12/h6-7,9-11,13H,8H2,1-5H3/t11-,12-/m0/s1
InChIKey MDBJKLZQVUGVEA-RYUDHWBXSA-N
Molecular Weight 326.406 g/mol
SMILES O[C@@]1([C@@](P(OC(C)C)(OC(C)C)=O)(SCC=C1)SC)[H]
SPLASH splash10-01vo-9420000000-aeba6e7ec8be43cc2909
Source of Spectrum K1-2004-168-12
Wiley ID 1559927